5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide

C118H176N32O13S — CID 161190186

IUPAC5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
SMILESCCc1nc(C(C)C)c(C(=O)N(C)C)s1.CCn1cc(NC)cc1C(=O)N1CCCC1.CNC(=O)c1cc(C)nc(NC)c1.CNc1cc(C(=O)N(C)C)cc(C)n1.CNc1cc(C(=O)N(C)C)ccn1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(=O)N2CCCC2)ccn1.CNc1cc(C(=O)N2CCOCC2)cc(C)n1.CNc1cc(C(=O)N2CCOCC2)ccn1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1ccoc1
InChIInChI=1S/C12H17N3O2.C12H17N3O.C12H19N3O.C11H15N3O2.C11H15N3O.C11H18N2OS.C10H15N3O.2C9H13N3O.C8H13N3.C8H14N2O.C5H7NO/c1-9-7-10(8-11(13-2)14-9)12(16)15-3-5-17-6-4-15;1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-3-14-9-10(13-2)8-11(14)12(16)15-6-4-5-7-15;1-12-10-8-9(2-3-13-10)11(15)14-4-6-16-7-5-14;1-12-10-8-9(4-5-13-10)11(15)14-6-2-3-7-14;1-6-8-12-9(7(2)3)10(15-8)11(14)13(4)5;1-7-5-8(10(14)13(3)4)6-9(11-2)12-7;1-6-4-7(9(13)11-3)5-8(10-2)12-6;1-10-8-6-7(4-5-11-8)9(13)12(2)3;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h7-8H,3-6H2,1-2H3,(H,13,14);7-8H,3-6H2,1-2H3,(H,13,14);8-9,13H,3-7H2,1-2H3;2-3,8H,4-7H2,1H3,(H,12,13);4-5,8H,2-3,6-7H2,1H3,(H,12,13);7H,6H2,1-5H3;5-6H,1-4H3,(H,11,12);4-5H,1-3H3,(H,10,12)(H,11,13);4-6H,1-3H3,(H,10,11);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3
InChIKeyUTPPSJDKYYEJBT-UHFFFAOYSA-N
MW2282.98 g/mol
LogP16.27
Rot. Bonds24

About 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide

5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide (PubChem CID 161190186) has the molecular formula C118H176N32O13S and a molecular weight of 2282.98 g/mol. Its IUPAC name is 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
PubChem CID161190186
Molecular FormulaC118H176N32O13S
Molecular Weight2282.98 g/mol
Exact Mass2281.38
IUPAC Name5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
SMILESCCc1nc(C(C)C)c(C(=O)N(C)C)s1.CCn1cc(NC)cc1C(=O)N1CCCC1.CNC(=O)c1cc(C)nc(NC)c1.CNc1cc(C(=O)N(C)C)cc(C)n1.CNc1cc(C(=O)N(C)C)ccn1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(=O)N2CCCC2)ccn1.CNc1cc(C(=O)N2CCOCC2)cc(C)n1.CNc1cc(C(=O)N2CCOCC2)ccn1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1ccoc1
InChIInChI=1S/C12H17N3O2.C12H17N3O.C12H19N3O.C11H15N3O2.C11H15N3O.C11H18N2OS.C10H15N3O.2C9H13N3O.C8H13N3.C8H14N2O.C5H7NO/c1-9-7-10(8-11(13-2)14-9)12(16)15-3-5-17-6-4-15;1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-3-14-9-10(13-2)8-11(14)12(16)15-6-4-5-7-15;1-12-10-8-9(2-3-13-10)11(15)14-4-6-16-7-5-14;1-12-10-8-9(4-5-13-10)11(15)14-6-2-3-7-14;1-6-8-12-9(7(2)3)10(15-8)11(14)13(4)5;1-7-5-8(10(14)13(3)4)6-9(11-2)12-7;1-6-4-7(9(13)11-3)5-8(10-2)12-6;1-10-8-6-7(4-5-11-8)9(13)12(2)3;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h7-8H,3-6H2,1-2H3,(H,13,14);7-8H,3-6H2,1-2H3,(H,13,14);8-9,13H,3-7H2,1-2H3;2-3,8H,4-7H2,1H3,(H,12,13);4-5,8H,2-3,6-7H2,1H3,(H,12,13);7H,6H2,1-5H3;5-6H,1-4H3,(H,11,12);4-5H,1-3H3,(H,10,12)(H,11,13);4-6H,1-3H3,(H,10,11);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3
InChIKeyUTPPSJDKYYEJBT-UHFFFAOYSA-N
XLogP16.27
TPSA507.41 Ų
H-Bond Donors12
H-Bond Acceptors37
Rotatable Bonds24
Heavy Atoms164
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002282.98
LogP ≤ 516.27
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1037

Analyze 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;tetrakis(3-cyclopropyl-N,1-dimethylpyrazol-5-amine);4-(2,4-dimethylfuran-3-yl)-N-methylpyridin-2-amine;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,6-dimethyl-4-(5-methyl-1,2,4-oxadiazol-3-yl)pyridin-2-amine;N,6-dimethyl-4-(1-methyltetrazol-5-yl)pyridin-2-amine;2-ethyl-N,N-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;2-methoxy-N,N-dimethyl-6-(methylamino)pyridine-4-carboxamide;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;methyl 2-bromo-6-ethylpyridine-4-carboxylate;methyl 2-ethyl-6-methylpyridine-4-carboxylate
CID 157085956
3-propan-2-ylfuran;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;4-propan-2-yl-3H-pyrrole;bis(5-propan-2-yl-2H-tetrazole);2-propan-2-yl-1,3,4-thiadiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;3-propan-2-ylthiophene
CID 157105191
2,5-dimethylfuran;1,4-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);2,4-dimethyl-1,3-oxazole;bis(2,5-dimethyl-1,3-oxazole);bis(3,5-dimethyl-1,2-oxazole);2,5-dimethylpyrazine;3,5-dimethyl-1H-pyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3-fluoro-2,5-dimethylpyridine;methane;3,4,5-trimethyl-1,2-oxazole;2,3,5-trimethylpyridine;2,4,5-trimethyl-1,3-thiazole
CID 157150556
N-[4-(2-cyclopropyl-1,3-thiazol-5-yl)-2-pyridinyl]-2-methylpropanamide;N-[4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-2-pyridinyl]-2-methylpropanamide;2-methyl-N-[4-(3-methylimidazol-4-yl)-2-pyridinyl]propanamide;2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)-2-pyridinyl]propanamide;2-methyl-N-[4-(1-methylpyrazol-4-yl)-2-pyridinyl]propanamide;2-methyl-N-(4-morpholin-4-yl-2-pyridinyl)propanamide;2-methyl-N-[4-(1,3-oxazol-5-yl)-2-pyridinyl]propanamide;2-methyl-N-[4-(2-oxo-1,3-oxazolidin-3-yl)-2-pyridinyl]propanamide;2-methyl-N-(4-pyrrolidin-1-yl-2-pyridinyl)propanamide;2-methyl-N-[4-(1H-1,2,4-triazol-5-yl)-2-pyridinyl]propanamide;2-methyl-N-[4-(triazol-1-yl)-2-pyridinyl]propanamide;2-methyl-N-[4-(2H-triazol-4-yl)-2-pyridinyl]propanamide
CID 157174105
2,4-dimethyl-5-propan-2-yl-1,3-oxazole;4,5-dimethyl-3-propan-2-yl-1,2-oxazole;1,3-dimethyl-5-propan-2-ylpyrazole;2,3-dimethyl-5-propan-2-yl-1H-pyrazol-2-ium;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;2,5-dimethyl-4-propan-2-yl-1,3-thiazole;2-[(E)-3-methylbut-1-enyl]furan;2-[(E)-3-methylbut-1-enyl]pyridine;2-methyl-5-propan-2-yl-1,3,4-oxadiazole;3-methyl-5-propan-2-yl-1,2,4-oxadiazole;3-methyl-5-propan-2-yl-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;3-methyl-5-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;5-methyl-2-propan-2-ylpyridine;2-methyl-5-propan-2-yl-1,3,4-thiadiazole;3-methyl-5-propan-2-yl-4H-triazol-3-ium;2-propan-2-ylpyrazine;2-propan-2-ylpyridine
CID 157262008
CID 157323252
CID 157323252
N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-2-methylpropan-1-amine;2-methyl-N-[2-(4-methyl-1,3-oxazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propan-1-amine;2-methyl-N-[2-(6-methyl-2-pyridinyl)ethyl]propan-1-amine;2-methyl-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]propan-1-amine;2-methyl-N-[2-(1,3-oxazol-2-yl)ethyl]propan-1-amine;2-(2-methylpropylamino)-1-pyridin-2-ylethanone;2-methyl-N-(2-pyrazin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrazol-1-ylethyl)propan-1-amine;2-methyl-N-(2-pyridazin-3-ylethyl)propan-1-amine;2-methyl-N-(2-pyridin-2-ylethyl)propan-1-amine;2-methyl-N-(2-pyrimidin-4-ylethyl)propan-1-amine;2-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 157344041
1-Tert-butylimidazole;2-tert-butyl-1-methylimidazole;3-tert-butyl-1-methylpyrazole;5-tert-butyl-1-methyltriazole;2-tert-butyl-1,3-oxazole;5-tert-butyl-1,2-oxazole;1-tert-butylpyrazole;bis(2-tert-butyl-1,3-thiazole);2-tert-butyl-1,3,5-triazine;1-tert-butyltriazole;2-tert-butyltriazole;nonakis(2,2-dimethylpropane);furan;methane;2-methylfuran;1-methylimidazole;1-methylpyrrole;pyrazine;tris(pyridine);thiophene
CID 157391084
5-tert-butyl-N-methyl-1,2-oxazol-3-amine;bis(3-cyclopropyl-N,1-dimethylpyrazol-5-amine);[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide
CID 157441878
CID 157493653
CID 157493653
bis(2,3-dimethylfuran);bis(4,5-dimethyl-1H-imidazole);bis(3,4-dimethyl-1,2-oxazole);bis(4,5-dimethyl-1,2-oxazole);bis(4,5-dimethyl-1,3-oxazole);2,3-dimethylpyrazine;tetrakis(4,5-dimethyl-1H-pyrazole);bis(2,3-dimethylpyridine);bis(3,4-dimethylpyridine);bis(4,5-dimethylpyrimidine);bis(2,3-dimethyl-1H-pyrrole);3,4-dimethyl-1H-pyrrole;3,4-dimethyl-1,2-thiazole;bis(4,5-dimethyl-1,2-thiazole);bis(4,5-dimethyl-1,3-thiazole);bis(2,3-dimethylthiophene);methane
CID 157516199
4-butyl-N,N-dimethyl-2-(methylamino)-1,3-thiazole-5-carboxamide;N,6-dimethylpyridin-2-amine;ethyl 2-ethyl-6-methylpyridine-4-carboxylate;ethyl 2-ethylpyridine-4-carboxylate;ethyl 5-(methylamino)-1,3,4-thiadiazole-2-carboxylate;ethyl 1-methyl-3-(methylamino)pyrazole-5-carboxylate;4-methoxy-N-methylpyridin-2-amine;methyl 1-ethyl-4-(methylamino)pyrrole-2-carboxylate;methyl 1-methyl-4-(methylamino)pyrrole-2-carboxylate;N-methylpyridin-3-amine
CID 157530274

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
The IUPAC name of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide (CID 161190186) is 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide.
What is the SMILES notation for 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
The canonical SMILES for 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide is CCc1nc(C(C)C)c(C(=O)N(C)C)s1.CCn1cc(NC)cc1C(=O)N1CCCC1.CNC(=O)c1cc(C)nc(NC)c1.CNc1cc(C(=O)N(C)C)cc(C)n1.CNc1cc(C(=O)N(C)C)ccn1.CNc1cc(C(=O)N2CCCC2)cc(C)n1.CNc1cc(C(=O)N2CCCC2)ccn1.CNc1cc(C(=O)N2CCOCC2)cc(C)n1.CNc1cc(C(=O)N2CCOCC2)ccn1.CNc1cc(C(C)(C)C)on1.CNc1cc(C2CC2)nn1C.CNc1ccoc1.
What is the InChIKey of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
The InChIKey is UTPPSJDKYYEJBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2.C12H17N3O.C12H19N3O.C11H15N3O2.C11H15N3O.C11H18N2OS.C10H15N3O.2C9H13N3O.C8H13N3.C8H14N2O.C5H7NO/c1-9-7-10(8-11(13-2)14-9)12(16)15-3-5-17-6-4-15;1-9-7-10(8-11(13-2)14-9)12(16)15-5-3-4-6-15;1-3-14-9-10(13-2)8-11(14)12(16)15-6-4-5-7-15;1-12-10-8-9(2-3-13-10)11(15)14-4-6-16-7-5-14;1-12-10-8-9(4-5-13-10)11(15)14-6-2-3-7-14;1-6-8-12-9(7(2)3)10(15-8)11(14)13(4)5;1-7-5-8(10(14)13(3)4)6-9(11-2)12-7;1-6-4-7(9(13)11-3)5-8(10-2)12-6;1-10-8-6-7(4-5-11-8)9(13)12(2)3;1-9-8-5-7(6-3-4-6)10-11(8)2;1-8(2,3)6-5-7(9-4)10-11-6;1-6-5-2-3-7-4-5/h7-8H,3-6H2,1-2H3,(H,13,14);7-8H,3-6H2,1-2H3,(H,13,14);8-9,13H,3-7H2,1-2H3;2-3,8H,4-7H2,1H3,(H,12,13);4-5,8H,2-3,6-7H2,1H3,(H,12,13);7H,6H2,1-5H3;5-6H,1-4H3,(H,11,12);4-5H,1-3H3,(H,10,12)(H,11,13);4-6H,1-3H3,(H,10,11);5-6,9H,3-4H2,1-2H3;5H,1-4H3,(H,9,10);2-4,6H,1H3.
What are the key properties of 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide?
5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide has a molecular weight of 2282.98 g/mol, XLogP of 16.27, 24 rotatable bonds, 12 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-N-methyl-1,2-oxazol-3-amine;3-cyclopropyl-N,1-dimethylpyrazol-5-amine;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;2-ethyl-N,N-dimethyl-4-propan-2-yl-1,3-thiazole-5-carboxamide;[1-ethyl-4-(methylamino)pyrrol-2-yl]-pyrrolidin-1-ylmethanone;[2-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N-methylfuran-3-amine;[2-methyl-6-(methylamino)-4-pyridinyl]-morpholin-4-ylmethanone;[2-methyl-6-(methylamino)-4-pyridinyl]-pyrrolidin-1-ylmethanone;N,N,2-trimethyl-6-(methylamino)pyridine-4-carboxamide is sourced from PubChem (CID 161190186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).