6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen

C84H98N14O7 — CID 158112989

IUPAC6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen
SMILESC.C=C(C)c1ccc(-c2cnc(C)c(C(=O)Nc3ccccc3)n2)cc1.Cc1ncc(-c2cccc(C(=O)N3CCCCC3)c2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2cccc(C(N)=O)c2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2ccccc2CO)nc1C(=O)Nc1ccccc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C24H24N4O2.C21H19N3O.C19H16N4O2.C19H17N3O2.CH4.9H2/c1-17-22(23(29)26-20-11-4-2-5-12-20)27-21(16-25-17)18-9-8-10-19(15-18)24(30)28-13-6-3-7-14-28;1-14(2)16-9-11-17(12-10-16)19-13-22-15(3)20(24-19)21(25)23-18-7-5-4-6-8-18;1-12-17(19(25)22-15-8-3-2-4-9-15)23-16(11-21-12)13-6-5-7-14(10-13)18(20)24;1-13-18(19(24)21-15-8-3-2-4-9-15)22-17(11-20-13)16-10-6-5-7-14(16)12-23;;;;;;;;;;/h2,4-5,8-12,15-16H,3,6-7,13-14H2,1H3,(H,26,29);4-13H,1H2,2-3H3,(H,23,25);2-11H,1H3,(H2,20,24)(H,22,25);2-11,23H,12H2,1H3,(H,21,24);1H4;9*1H
InChIKeyFQQXUQPHIRIQSI-UHFFFAOYSA-N
MW1415.80 g/mol
LogP17.92
Rot. Bonds16

About 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen

6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen (PubChem CID 158112989) has the molecular formula C84H98N14O7 and a molecular weight of 1415.80 g/mol. Its IUPAC name is 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound Name6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen
PubChem CID158112989
Molecular FormulaC84H98N14O7
Molecular Weight1415.80 g/mol
Exact Mass1414.77
IUPAC Name6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen
SMILESC.C=C(C)c1ccc(-c2cnc(C)c(C(=O)Nc3ccccc3)n2)cc1.Cc1ncc(-c2cccc(C(=O)N3CCCCC3)c2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2cccc(C(N)=O)c2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2ccccc2CO)nc1C(=O)Nc1ccccc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C24H24N4O2.C21H19N3O.C19H16N4O2.C19H17N3O2.CH4.9H2/c1-17-22(23(29)26-20-11-4-2-5-12-20)27-21(16-25-17)18-9-8-10-19(15-18)24(30)28-13-6-3-7-14-28;1-14(2)16-9-11-17(12-10-16)19-13-22-15(3)20(24-19)21(25)23-18-7-5-4-6-8-18;1-12-17(19(25)22-15-8-3-2-4-9-15)23-16(11-21-12)13-6-5-7-14(10-13)18(20)24;1-13-18(19(24)21-15-8-3-2-4-9-15)22-17(11-20-13)16-10-6-5-7-14(16)12-23;;;;;;;;;;/h2,4-5,8-12,15-16H,3,6-7,13-14H2,1H3,(H,26,29);4-13H,1H2,2-3H3,(H,23,25);2-11H,1H3,(H2,20,24)(H,22,25);2-11,23H,12H2,1H3,(H,21,24);1H4;9*1H
InChIKeyFQQXUQPHIRIQSI-UHFFFAOYSA-N
XLogP17.92
TPSA303.15 Ų
H-Bond Donors6
H-Bond Acceptors15
Rotatable Bonds16
Heavy Atoms105
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001415.80
LogP ≤ 517.92
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1015

Analyze 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen 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-amino-8-N-[6-[[4-[(3-amino-2,2-difluoropropyl)carbamoyl]phenyl]methyl]-7,8-dihydro-5H-1,6-naphthyridin-3-yl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-8-N-[5-(4-amino-3-oxobutyl)-3-pyridinyl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-fluoro-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-(hydroxymethyl)-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide
CID 159090108
2-amino-8-N-[6-[[4-[(3-amino-2,2-difluoropropyl)carbamoyl]phenyl]methyl]-7,8-dihydro-5H-1,6-naphthyridin-3-yl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-8-N-[6-[[4-(2-aminoethylcarbamoyl)phenyl]methyl]-7,8-dihydro-5H-1,6-naphthyridin-3-yl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-fluoro-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-(hydroxymethyl)-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide
CID 159984074
3-[(1S)-1-aminoethyl]-2-phenyl-8-(trifluoromethyl)isoquinolin-1-one;1,6-naphthyridine-8-carboxylic acid;N-[(1S)-1-[1-oxo-2-phenyl-8-(trifluoromethyl)isoquinolin-3-yl]ethyl]-1,6-naphthyridine-8-carboxamide
CID 160357061
2-amino-8-N-[6-[[4-[(3-amino-2,2-difluoropropyl)carbamoyl]phenyl]methyl]-7,8-dihydro-5H-1,6-naphthyridin-3-yl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-8-N-[5-(4-amino-3-oxobutyl)-3-pyridinyl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-fluoro-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-(hydroxymethyl)-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide;methane
CID 160683632
2-Methyl-6-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine;3-methyl-2-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine;4-methyl-2-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine;methyl 2-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine-3-carboxylate;bis(methyl 2-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine-4-carboxylate);2-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine-4-carboxamide;6-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine-2-carboxamide;6-[3-[2-(trifluoromethyl)phenyl]phenyl]pyridine-2-carboxylic acid
CID 160696486
2-fluoro-5-[3-(1H-isoindol-5-yl)-2-pyridinyl]benzamide;2-fluoro-5-[3-(1H-isoindol-5-yl)-2-pyridinyl]-N,N-dimethylbenzamide;2-fluoro-5-[3-(1H-isoindol-5-yl)-2-pyridinyl]-N-propylbenzamide;5-[2-[4-fluoro-3-(trifluoromethyl)phenyl]-3-pyridinyl]-1H-isoindole;[3-[3-(1H-isoindol-5-yl)-2-pyridinyl]phenyl]methanol;4-[3-(1H-isoindol-5-yl)-2-pyridinyl]-N,N,2-trimethylaniline
CID 161025411
2-amino-8-N-[6-[[4-[(3-amino-2,2-difluoropropyl)carbamoyl]phenyl]methyl]-7,8-dihydro-5H-1,6-naphthyridin-3-yl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-8-N-[6-[[4-(2-aminoethylcarbamoyl)phenyl]methyl]-7,8-dihydro-5H-1,6-naphthyridin-3-yl]-4-N,4-N-dipropyl-3H-1-benzazepine-4,8-dicarboxamide;2-amino-4-N,4-N-dipropyl-8-N-[6-[[4-(propylcarbamoyl)phenyl]methyl]-7,8-dihydro-5H-1,6-naphthyridin-3-yl]-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-fluoro-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide;2-amino-7-(hydroxymethyl)-4-N,4-N-dipropyl-8-N-(5,6,7,8-tetrahydro-1,6-naphthyridin-3-yl)-3H-1-benzazepine-4,8-dicarboxamide
CID 161271997
4-[[3-[[4-[2-[4-[[1-[3-amino-5-(1-ethylpiperidin-3-yl)pyridine-2-carbonyl]piperidin-4-yl]methyl]piperazin-1-yl]acetyl]piperazin-1-yl]-hydroxymethyl]-4-fluorophenyl]methyl]-2H-phthalazin-1-one
CID 176578358
5-[4-[(1S,3R)-3-[8-fluoro-7-[[[5-[4-[3-(8-fluoro-1-hydroxy-1,2-dihydroisoquinolin-3-yl)cyclopentyl]piperazin-1-yl]pyridine-2-carbonyl]amino]methyl]-1-hydroxy-1,2-dihydroisoquinolin-3-yl]cyclopentyl]piperazin-1-yl]-N-methylpyridine-2-carboxamide
CID 176964528
11-(3,5-Diphenylphenyl)-20-hydroxy-1,4,7-triazapentacyclo[11.7.1.03,8.09,21.014,19]henicosa-3,5,7,9(21),10,12,14,16,18-nonaen-2-one
CID 123793982
1-N-benzo[h]quinolin-3-yl-3-N-[7-[4-[5-[[3-[benzo[h]quinolin-3-yl(2,2-dimethylpropyl)carbamoyl]-5-[[2,2-dimethylpropyl-(5-methyl-6-phenyl-3-pyridinyl)amino]-hydroxymethyl]benzoyl]-(2,2-dimethylpropyl)amino]-3-methyl-2-pyridinyl]phenyl]benzo[h]quinolin-3-yl]-1-N,3-N,5-N-trimethyl-5-N-(5-methyl-6-phenyl-3-pyridinyl)benzene-1,3,5-tricarboxamide
CID 126639019
4-[[(2R,6S)-2-[5-[6-[(2S,6R)-1-[[4-carbamoyl-2-(hydroxymethyl)phenyl]methyl]-6-(3-methyl-2-pyridinyl)piperidin-2-yl]-5-methyl-3-pyridinyl]-3-methyl-2-pyridinyl]-6-(3-methyl-2-pyridinyl)piperidin-1-yl]methyl]-3-(hydroxymethyl)benzoic acid
CID 142959304

Frequently Asked Questions

What is the IUPAC name of 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
The IUPAC name of 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen (CID 158112989) is 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen.
What is the SMILES notation for 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
The canonical SMILES for 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen is C.C=C(C)c1ccc(-c2cnc(C)c(C(=O)Nc3ccccc3)n2)cc1.Cc1ncc(-c2cccc(C(=O)N3CCCCC3)c2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2cccc(C(N)=O)c2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2ccccc2CO)nc1C(=O)Nc1ccccc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
The InChIKey is FQQXUQPHIRIQSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O2.C21H19N3O.C19H16N4O2.C19H17N3O2.CH4.9H2/c1-17-22(23(29)26-20-11-4-2-5-12-20)27-21(16-25-17)18-9-8-10-19(15-18)24(30)28-13-6-3-7-14-28;1-14(2)16-9-11-17(12-10-16)19-13-22-15(3)20(24-19)21(25)23-18-7-5-4-6-8-18;1-12-17(19(25)22-15-8-3-2-4-9-15)23-16(11-21-12)13-6-5-7-14(10-13)18(20)24;1-13-18(19(24)21-15-8-3-2-4-9-15)22-17(11-20-13)16-10-6-5-7-14(16)12-23;;;;;;;;;;/h2,4-5,8-12,15-16H,3,6-7,13-14H2,1H3,(H,26,29);4-13H,1H2,2-3H3,(H,23,25);2-11H,1H3,(H2,20,24)(H,22,25);2-11,23H,12H2,1H3,(H,21,24);1H4;9*1H.
What are the key properties of 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen has a molecular weight of 1415.80 g/mol, XLogP of 17.92, 16 rotatable bonds, 6 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-carbamoylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;6-[2-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;methane;3-methyl-N-phenyl-6-[3-(piperidine-1-carbonyl)phenyl]pyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-prop-1-en-2-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 158112989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).