2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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

C95H142BrN25O11S — CID 160763798

IUPAC2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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
SMILESCCc1cc(C(=O)N(C)C)cc(Br)n1.CCc1cc(C(=O)N(C)C)cc(NC)n1.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(C)C)n1.CNc1cc(C(=O)N(C)C)cc(OC)n1.CNc1cc(C(=O)N(C)C)ccn1.CNc1cc(C(=O)N2CCOCC2)ccn1
InChIInChI=1S/2C12H19N3O.C11H15N3O2.C11H17N3O.C11H18N2OS.C10H13BrN2O.C10H15N3O2.2C9H13N3O/c1-3-14-9-10(13-2)8-11(14)12(16)15-6-4-5-7-15;1-8(2)10-6-9(12(16)15(4)5)7-11(13-3)14-10;1-12-10-8-9(2-3-13-10)11(15)14-4-6-16-7-5-14;1-5-9-6-8(11(15)14(3)4)7-10(12-2)13-9;1-6-8-12-9(7(2)3)10(15-8)11(14)13(4)5;1-4-8-5-7(6-9(11)12-8)10(14)13(2)3;1-11-8-5-7(10(14)13(2)3)6-9(12-8)15-4;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/h8-9,13H,3-7H2,1-2H3;6-8H,1-5H3,(H,13,14);2-3,8H,4-7H2,1H3,(H,12,13);6-7H,5H2,1-4H3,(H,12,13);7H,6H2,1-5H3;5-6H,4H2,1-3H3;5-6H,1-4H3,(H,11,12);4-5H,1-3H3,(H,10,12)(H,11,13);4-6H,1-3H3,(H,10,11)
InChIKeyRYKLEPBGVQNMSA-UHFFFAOYSA-N
MW1922.32 g/mol
LogP12.81
Rot. Bonds23

About 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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

2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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 (PubChem CID 160763798) has the molecular formula C95H142BrN25O11S and a molecular weight of 1922.32 g/mol. Its IUPAC name is 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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.

Molecular Properties

Compound Name2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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
PubChem CID160763798
Molecular FormulaC95H142BrN25O11S
Molecular Weight1922.32 g/mol
Exact Mass1920.02
IUPAC Name2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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
SMILESCCc1cc(C(=O)N(C)C)cc(Br)n1.CCc1cc(C(=O)N(C)C)cc(NC)n1.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(C)C)n1.CNc1cc(C(=O)N(C)C)cc(OC)n1.CNc1cc(C(=O)N(C)C)ccn1.CNc1cc(C(=O)N2CCOCC2)ccn1
InChIInChI=1S/2C12H19N3O.C11H15N3O2.C11H17N3O.C11H18N2OS.C10H13BrN2O.C10H15N3O2.2C9H13N3O/c1-3-14-9-10(13-2)8-11(14)12(16)15-6-4-5-7-15;1-8(2)10-6-9(12(16)15(4)5)7-11(13-3)14-10;1-12-10-8-9(2-3-13-10)11(15)14-4-6-16-7-5-14;1-5-9-6-8(11(15)14(3)4)7-10(12-2)13-9;1-6-8-12-9(7(2)3)10(15-8)11(14)13(4)5;1-4-8-5-7(6-9(11)12-8)10(14)13(2)3;1-11-8-5-7(10(14)13(2)3)6-9(12-8)15-4;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/h8-9,13H,3-7H2,1-2H3;6-8H,1-5H3,(H,13,14);2-3,8H,4-7H2,1H3,(H,12,13);6-7H,5H2,1-4H3,(H,12,13);7H,6H2,1-5H3;5-6H,4H2,1-3H3;5-6H,1-4H3,(H,11,12);4-5H,1-3H3,(H,10,12)(H,11,13);4-6H,1-3H3,(H,10,11)
InChIKeyRYKLEPBGVQNMSA-UHFFFAOYSA-N
XLogP12.81
TPSA402.30 Ų
H-Bond Donors8
H-Bond Acceptors28
Rotatable Bonds23
Heavy Atoms133
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001922.32
LogP ≤ 512.81
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1028

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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 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

Frequently Asked Questions

What is the IUPAC name of 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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?
The IUPAC name of 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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 (CID 160763798) is 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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.
What is the SMILES notation for 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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?
The canonical SMILES for 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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 is CCc1cc(C(=O)N(C)C)cc(Br)n1.CCc1cc(C(=O)N(C)C)cc(NC)n1.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(C)C)n1.CNc1cc(C(=O)N(C)C)cc(OC)n1.CNc1cc(C(=O)N(C)C)ccn1.CNc1cc(C(=O)N2CCOCC2)ccn1.
What is the InChIKey of 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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?
The InChIKey is RYKLEPBGVQNMSA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H19N3O.C11H15N3O2.C11H17N3O.C11H18N2OS.C10H13BrN2O.C10H15N3O2.2C9H13N3O/c1-3-14-9-10(13-2)8-11(14)12(16)15-6-4-5-7-15;1-8(2)10-6-9(12(16)15(4)5)7-11(13-3)14-10;1-12-10-8-9(2-3-13-10)11(15)14-4-6-16-7-5-14;1-5-9-6-8(11(15)14(3)4)7-10(12-2)13-9;1-6-8-12-9(7(2)3)10(15-8)11(14)13(4)5;1-4-8-5-7(6-9(11)12-8)10(14)13(2)3;1-11-8-5-7(10(14)13(2)3)6-9(12-8)15-4;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/h8-9,13H,3-7H2,1-2H3;6-8H,1-5H3,(H,13,14);2-3,8H,4-7H2,1H3,(H,12,13);6-7H,5H2,1-4H3,(H,12,13);7H,6H2,1-5H3;5-6H,4H2,1-3H3;5-6H,1-4H3,(H,11,12);4-5H,1-3H3,(H,10,12)(H,11,13);4-6H,1-3H3,(H,10,11).
What are the key properties of 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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?
2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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 has a molecular weight of 1922.32 g/mol, XLogP of 12.81, 23 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-6-ethyl-N,N-dimethylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)-6-propan-2-ylpyridine-4-carboxamide;N,N-dimethyl-2-(methylamino)pyridine-4-carboxamide;N,2-dimethyl-6-(methylamino)pyridine-4-carboxamide;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 is sourced from PubChem (CID 160763798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).