2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid

C145H209F3N24O11 — CID 160682146

IUPAC2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid
SMILESC.C.CC(C)c1ccc(C(=O)O)c(N)n1.CC(C)c1ccc(C(=O)O)cn1.CC(C)c1nc(C(=O)O)ccc1F.CC(C)c1nccc(C(=O)O)n1.COc1ccc(C(C)C)nc1C.Cc1cc(C)nc(C(C)C)n1.Cc1ccc(C(C)C)nc1C.Cc1ccc(C)c(C(C)C)n1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)n1.Cc1cnc(C(C)C)c(F)c1.Cc1cnc(C(C)C)nc1.Cc1cnc(C(C)C)nc1C.Cc1cncc(C(C)C)n1.Cc1nc(C(C)C)ccc1F.Cc1nc(C(C)C)ncc1C(=O)O
InChIInChI=1S/C10H15NO.2C10H15N.C9H10FNO2.2C9H12FN.2C9H12N2O2.2C9H14N2.C9H11NO2.C9H13N.C8H10N2O2.3C8H12N2.2CH4/c1-7(2)9-5-6-10(12-4)8(3)11-9;1-7(2)10-6-5-8(3)9(4)11-10;1-7(2)10-8(3)5-6-9(4)11-10;1-5(2)8-6(10)3-4-7(11-8)9(12)13;1-6(2)9-8(10)4-7(3)5-11-9;1-6(2)9-5-4-8(10)7(3)11-9;1-5(2)8-10-4-7(9(12)13)6(3)11-8;1-5(2)7-4-3-6(9(12)13)8(10)11-7;1-6(2)9-10-5-7(3)8(4)11-9;1-6(2)9-10-7(3)5-8(4)11-9;1-6(2)8-4-3-7(5-10-8)9(11)12;1-7(2)9-6-4-5-8(3)10-9;1-5(2)7-9-4-3-6(10-7)8(11)12;1-6(2)8-5-9-4-7(3)10-8;1-6(2)8-9-4-7(3)5-10-8;1-6(2)8-9-5-4-7(3)10-8;;/h5-7H,1-4H3;2*5-7H,1-4H3;3-5H,1-2H3,(H,12,13);2*4-6H,1-3H3;4-5H,1-3H3,(H,12,13);3-5H,1-2H3,(H2,10,11)(H,12,13);2*5-6H,1-4H3;3-6H,1-2H3,(H,11,12);4-7H,1-3H3;3-5H,1-2H3,(H,11,12);3*4-6H,1-3H3;2*1H4
InChIKeyROHCKFSXKRNZOA-UHFFFAOYSA-N
MW2521.42 g/mol
LogP35.75
Rot. Bonds22

About 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid

2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid (PubChem CID 160682146) has the molecular formula C145H209F3N24O11 and a molecular weight of 2521.42 g/mol. Its IUPAC name is 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid.

Molecular Properties

Compound Name2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid
PubChem CID160682146
Molecular FormulaC145H209F3N24O11
Molecular Weight2521.42 g/mol
Exact Mass2519.65
IUPAC Name2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid
SMILESC.C.CC(C)c1ccc(C(=O)O)c(N)n1.CC(C)c1ccc(C(=O)O)cn1.CC(C)c1nc(C(=O)O)ccc1F.CC(C)c1nccc(C(=O)O)n1.COc1ccc(C(C)C)nc1C.Cc1cc(C)nc(C(C)C)n1.Cc1ccc(C(C)C)nc1C.Cc1ccc(C)c(C(C)C)n1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)n1.Cc1cnc(C(C)C)c(F)c1.Cc1cnc(C(C)C)nc1.Cc1cnc(C(C)C)nc1C.Cc1cncc(C(C)C)n1.Cc1nc(C(C)C)ccc1F.Cc1nc(C(C)C)ncc1C(=O)O
InChIInChI=1S/C10H15NO.2C10H15N.C9H10FNO2.2C9H12FN.2C9H12N2O2.2C9H14N2.C9H11NO2.C9H13N.C8H10N2O2.3C8H12N2.2CH4/c1-7(2)9-5-6-10(12-4)8(3)11-9;1-7(2)10-6-5-8(3)9(4)11-10;1-7(2)10-8(3)5-6-9(4)11-10;1-5(2)8-6(10)3-4-7(11-8)9(12)13;1-6(2)9-8(10)4-7(3)5-11-9;1-6(2)9-5-4-8(10)7(3)11-9;1-5(2)8-10-4-7(9(12)13)6(3)11-8;1-5(2)7-4-3-6(9(12)13)8(10)11-7;1-6(2)9-10-5-7(3)8(4)11-9;1-6(2)9-10-7(3)5-8(4)11-9;1-6(2)8-4-3-7(5-10-8)9(11)12;1-7(2)9-6-4-5-8(3)10-9;1-5(2)7-9-4-3-6(10-7)8(11)12;1-6(2)8-5-9-4-7(3)10-8;1-6(2)8-9-4-7(3)5-10-8;1-6(2)8-9-5-4-7(3)10-8;;/h5-7H,1-4H3;2*5-7H,1-4H3;3-5H,1-2H3,(H,12,13);2*4-6H,1-3H3;4-5H,1-3H3,(H,12,13);3-5H,1-2H3,(H2,10,11)(H,12,13);2*5-6H,1-4H3;3-6H,1-2H3,(H,11,12);4-7H,1-3H3;3-5H,1-2H3,(H,11,12);3*4-6H,1-3H3;2*1H4
InChIKeyROHCKFSXKRNZOA-UHFFFAOYSA-N
XLogP35.75
TPSA518.22 Ų
H-Bond Donors6
H-Bond Acceptors30
Rotatable Bonds22
Heavy Atoms183
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002521.42
LogP ≤ 535.75
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1030

Analyze 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid 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

5-(4-(((1S,2S)-2-(5-methoxypyridin-2-yl)cyclopropyl)methoxy)-2-methylpyrimidin-5-yl)pyrazine-2-carboxylic acid
CID 76283026
Ethyl 6-ethoxy-7-methyl-4-(4-phenylmethoxyanilino)-1,8-naphthyridine-3-carboxylate;ethyl 6-ethoxy-7-methyl-4-[4-(trifluoromethoxy)anilino]-1,8-naphthyridine-3-carboxylate
CID 67873187
4-[6-(6-Amino-2-methylpyrimidin-4-yl)-5-[(5-fluoro-6-methoxy-3-pyridinyl)amino]pyrazin-2-yl]-2-[6-(6-amino-2-methylpyrimidin-4-yl)-5-[(6-methoxy-3-pyridinyl)amino]pyrazin-2-yl]-4-hydroxypentanal
CID 90820325
Methyl 2-[2-[2-(6-acetamido-3-pyridinyl)-6-methoxy-3-pyridinyl]-5-methoxy-3-pyridinyl]-4-(5-fluoro-2-pyridin-3-yl-3-pyridinyl)-5-(6-methoxycarbonyl-2-pyridinyl)pyridine-3-carboxylate
CID 123161154
2-[6-(1,1-Difluoroethyl)-2-pyridinyl]-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-[5-fluoro-6-(1-fluoroethyl)-2-pyridinyl]-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(2-methyl-4-pyridinyl)-1-(4-pyridin-3-yloxy-2-pyridinyl)ethanone
CID 123597482
2-Cycloheptyl-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-[6-(1,1-difluoroethyl)-2-pyridinyl]-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(6-methoxy-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone;2-(4-methyl-2-pyridinyl)-1-(4-pyrimidin-5-yloxy-2-pyridinyl)ethanone
CID 123965770
Methyl 2-[4-[2-[2-[6-acetamido-2-[2-(2-methoxy-3-pyridin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-3-pyridinyl]-6-methoxy-3-pyridinyl]-5-methoxy-3-pyridinyl]-2-methoxy-3-pyridinyl]-4-(5-fluoro-2-pyridin-3-yl-3-pyridinyl)-5-(6-methoxycarbonyl-2-pyridinyl)pyridine-3-carboxylate
CID 123986562
2-Tert-butyl-5-chloropyridine;ethyl 6-propan-2-ylpyridine-3-carboxylate;methane;5-methoxy-2-propan-2-ylpyridine;2-methyl-5-propan-2-ylfuran;4-methyl-2-propan-2-ylpyrimidine;2-propan-2-ylpyridine;1-(6-propan-2-yl-3-pyridinyl)ethanol;2-propan-2-ylpyrimidine;2-propan-2-yl-6-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyridine;2-propan-2-yl-4-(trifluoromethyl)pyrimidine
CID 157453987
tris(carbon dioxide);bis(2,3-dimethyl-6-propan-2-ylpyridine);3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-6-methyl-2-propan-2-ylpyridine;5-fluoro-2-propan-2-ylpyridine-4-carboxylic acid;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methoxy-6-propan-2-ylpyridine-3-carboxylic acid;3-methyl-6-propan-2-ylpyridin-2-amine;2-methyl-5-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyridine;4-methyl-6-propan-2-ylpyridine-2-carboxylic acid;4-methyl-6-propan-2-ylpyridine-3-carboxylic acid;5-methyl-2-propan-2-ylpyridine-4-carboxylic acid;2-propan-2-ylpyridine;2-propan-2-ylpyridine-4-carboxylic acid;5-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-yl-6-(4H-triazol-5-yl)pyridine;2-propan-2-yl-4-(trifluoromethyl)benzoic acid
CID 157541887
2-cyclopropyl-5-propan-2-ylpyridine;2,5-di(propan-2-yl)pyridine;2-methoxy-5-propan-2-ylpyridine;nonakis(2-methyl-5-propan-2-ylpyridine);bis(3-methyl-5-propan-2-ylpyridine);4-methyl-3-propan-2-ylpyridine;1-methyl-3-propan-2-ylpyridin-1-ium;2-propan-2-ylpyrazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;N-(5-propan-2-yl-2-pyridinyl)acetamide;(5-propan-2-yl-2-pyridinyl)methanol;2-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;5-propan-2-yl-2-(trifluoromethyl)pyridine
CID 157894764
2-Cyclopropyl-5-propan-2-ylpyridine;2,5-di(propan-2-yl)pyridine;2-ethyl-5-propan-2-ylpyridine;methane;2-methyl-5-propan-2-ylpyrazine;hexakis(2-methyl-5-propan-2-ylpyridine);methyl 5-propan-2-ylpyridine-2-carboxylate;2-methyl-5-propan-2-ylpyrimidine;5-propan-2-yl-2-propylpyridine;5-propan-2-ylpyridine-2-carboxylic acid;(5-propan-2-yl-2-pyridinyl)methanol;2-propan-2-yl-5-(trifluoromethyl)pyrazine;5-propan-2-yl-2-(trifluoromethyl)pyridine;5-propan-2-yl-2-(trifluoromethyl)pyrimidine
CID 157896763
Tert-butylbenzene;2-tert-butyl-3,5-difluoropyridine;1-tert-butyl-3-fluoro-5-methoxybenzene;6-tert-butyl-3-fluoro-2-methylpyridine;2-tert-butyl-3-fluoropyridine;2-tert-butyl-5-fluoropyridine;2-tert-butyl-3-methoxypyridine;2-tert-butyl-5-methylpyridine;2-tert-butyl-6-methylpyridine;2-tert-butyl-6-methyl-3-(trifluoromethyl)pyridine;bis(2-tert-butylpyrazine);6-tert-butylpyridine-3-carboxamide;6-tert-butylpyridine-3-carboxylic acid;2-tert-butylpyrimidine;2-tert-butyl-5-(trifluoromethyl)pyridine;propan-2-yl 6-tert-butylpyridine-3-carboxylate
CID 158044750

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid?
The IUPAC name of 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid (CID 160682146) is 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid.
What is the SMILES notation for 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid?
The canonical SMILES for 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid is C.C.CC(C)c1ccc(C(=O)O)c(N)n1.CC(C)c1ccc(C(=O)O)cn1.CC(C)c1nc(C(=O)O)ccc1F.CC(C)c1nccc(C(=O)O)n1.COc1ccc(C(C)C)nc1C.Cc1cc(C)nc(C(C)C)n1.Cc1ccc(C(C)C)nc1C.Cc1ccc(C)c(C(C)C)n1.Cc1cccc(C(C)C)n1.Cc1ccnc(C(C)C)n1.Cc1cnc(C(C)C)c(F)c1.Cc1cnc(C(C)C)nc1.Cc1cnc(C(C)C)nc1C.Cc1cncc(C(C)C)n1.Cc1nc(C(C)C)ccc1F.Cc1nc(C(C)C)ncc1C(=O)O.
What is the InChIKey of 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid?
The InChIKey is ROHCKFSXKRNZOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO.2C10H15N.C9H10FNO2.2C9H12FN.2C9H12N2O2.2C9H14N2.C9H11NO2.C9H13N.C8H10N2O2.3C8H12N2.2CH4/c1-7(2)9-5-6-10(12-4)8(3)11-9;1-7(2)10-6-5-8(3)9(4)11-10;1-7(2)10-8(3)5-6-9(4)11-10;1-5(2)8-6(10)3-4-7(11-8)9(12)13;1-6(2)9-8(10)4-7(3)5-11-9;1-6(2)9-5-4-8(10)7(3)11-9;1-5(2)8-10-4-7(9(12)13)6(3)11-8;1-5(2)7-4-3-6(9(12)13)8(10)11-7;1-6(2)9-10-5-7(3)8(4)11-9;1-6(2)9-10-7(3)5-8(4)11-9;1-6(2)8-4-3-7(5-10-8)9(11)12;1-7(2)9-6-4-5-8(3)10-9;1-5(2)7-9-4-3-6(10-7)8(11)12;1-6(2)8-5-9-4-7(3)10-8;1-6(2)8-9-4-7(3)5-10-8;1-6(2)8-9-5-4-7(3)10-8;;/h5-7H,1-4H3;2*5-7H,1-4H3;3-5H,1-2H3,(H,12,13);2*4-6H,1-3H3;4-5H,1-3H3,(H,12,13);3-5H,1-2H3,(H2,10,11)(H,12,13);2*5-6H,1-4H3;3-6H,1-2H3,(H,11,12);4-7H,1-3H3;3-5H,1-2H3,(H,11,12);3*4-6H,1-3H3;2*1H4.
What are the key properties of 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid?
2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid has a molecular weight of 2521.42 g/mol, XLogP of 35.75, 22 rotatable bonds, 6 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-propan-2-ylpyridine-3-carboxylic acid;2,3-dimethyl-6-propan-2-ylpyridine;3,6-dimethyl-2-propan-2-ylpyridine;4,5-dimethyl-2-propan-2-ylpyrimidine;4,6-dimethyl-2-propan-2-ylpyrimidine;3-fluoro-2-methyl-6-propan-2-ylpyridine;3-fluoro-5-methyl-2-propan-2-ylpyridine;5-fluoro-6-propan-2-ylpyridine-2-carboxylic acid;methane;3-methoxy-2-methyl-6-propan-2-ylpyridine;2-methyl-6-propan-2-ylpyrazine;2-methyl-6-propan-2-ylpyridine;4-methyl-2-propan-2-ylpyrimidine;5-methyl-2-propan-2-ylpyrimidine;4-methyl-2-propan-2-ylpyrimidine-5-carboxylic acid;6-propan-2-ylpyridine-3-carboxylic acid;2-propan-2-ylpyrimidine-4-carboxylic acid is sourced from PubChem (CID 160682146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).