3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen

C59H68FN11O4 — CID 159300646

IUPAC3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen
SMILESCc1ncc(-c2ccc(CO)cc2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2ccc(N3CCCCC3)cc2)nc1C(=O)Nc1ccccc1.Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1ccccc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C23H24N4O.C19H17N3O2.C17H13FN4O.7H2/c1-17-22(23(28)25-19-8-4-2-5-9-19)26-21(16-24-17)18-10-12-20(13-11-18)27-14-6-3-7-15-27;1-13-18(19(24)21-16-5-3-2-4-6-16)22-17(11-20-13)15-9-7-14(12-23)8-10-15;18-13-9-5-4-8-12(13)14-10-20-16(19)15(22-14)17(23)21-11-6-2-1-3-7-11;;;;;;;/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3,(H,25,28);2-11,23H,12H2,1H3,(H,21,24);1-10H,(H2,19,20)(H,21,23);7*1H
InChIKeyLBHDWNIYNHFOAA-UHFFFAOYSA-N
MW1014.26 g/mol
LogP12.73
Rot. Bonds11

About 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen

3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen (PubChem CID 159300646) has the molecular formula C59H68FN11O4 and a molecular weight of 1014.26 g/mol. Its IUPAC name is 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen.

Molecular Properties

Compound Name3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen
PubChem CID159300646
Molecular FormulaC59H68FN11O4
Molecular Weight1014.26 g/mol
Exact Mass1013.54
IUPAC Name3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen
SMILESCc1ncc(-c2ccc(CO)cc2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2ccc(N3CCCCC3)cc2)nc1C(=O)Nc1ccccc1.Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1ccccc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C23H24N4O.C19H17N3O2.C17H13FN4O.7H2/c1-17-22(23(28)25-19-8-4-2-5-9-19)26-21(16-24-17)18-10-12-20(13-11-18)27-14-6-3-7-15-27;1-13-18(19(24)21-16-5-3-2-4-6-16)22-17(11-20-13)15-9-7-14(12-23)8-10-15;18-13-9-5-4-8-12(13)14-10-20-16(19)15(22-14)17(23)21-11-6-2-1-3-7-11;;;;;;;/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3,(H,25,28);2-11,23H,12H2,1H3,(H,21,24);1-10H,(H2,19,20)(H,21,23);7*1H
InChIKeyLBHDWNIYNHFOAA-UHFFFAOYSA-N
XLogP12.73
TPSA214.13 Ų
H-Bond Donors5
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms75
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001014.26
LogP ≤ 512.73
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1012

Analyze 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-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

3-amino-6-[4-(hydroxymethyl)phenyl]-N-phenylpyrazine-2-carboxamide
CID 59471893
3-amino-N-[3-(4-amino-4-methylpiperidin-1-yl)-2-pyridinyl]-6-[3-fluoro-4-(hydroxymethyl)-2-pyridinyl]pyrazine-2-carboxamide
CID 138742449
6-(3-acetylphenyl)-3-methyl-N-phenylpyrazine-2-carboxamide;3-amino-N-phenyl-6-[2-(trifluoromethyl)phenyl]pyrazine-2-carboxamide;6-[4-(1-hydroxyethenyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-6-[4-[(methyl-methylidene-oxo-lambda6-sulfanyl)amino]phenyl]-N-phenylpyrazine-2-carboxamide;molecular hydrogen
CID 157817437
3-amino-N-phenyl-6-[2-(trifluoromethyl)phenyl]pyrazine-2-carboxamide;6-[4-(methanesulfonamido)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-[5-methyl-6-(phenylcarbamoyl)pyrazin-2-yl]benzoic acid;4-[5-methyl-6-(phenylcarbamoyl)pyrazin-2-yl]benzoic acid;molecular hydrogen
CID 159844548
3-amino-6-[4-(methanesulfonamido)phenyl]-N-phenylpyrazine-2-carboxamide;3-[5-amino-6-(phenylcarbamoyl)pyrazin-2-yl]benzoic acid;4-[5-amino-6-(phenylcarbamoyl)pyrazin-2-yl]benzoic acid;3-amino-N-phenyl-6-[2-(trifluoromethyl)phenyl]pyrazine-2-carboxamide;molecular hydrogen
CID 161897269
3-amino-N-[4-(dihydroxymethyl)-3-fluorophenyl]-6-(4-methylphenyl)pyrazine-2-carboxamide
CID 166696539
3-[4-[[4-[[4-[2-[4-[1-[[4-(6-Amino-3-pyridinyl)-7-methyl-7,8-dihydroquinolin-6-yl]methyl]piperidin-4-yl]phenyl]-2-hydroxyethyl]cyclohexyl]methyl]piperazin-1-yl]methyl]-3-fluoroanilino]piperidine-2,6-dione
CID 177355651
3-amino-6-[4-(hydroxymethyl)phenyl]-N-pyridin-3-ylpyrazine-2-carboxamide
CID 58065588
3-amino-6-[4-[3-(3-methoxypropylamino)propyl]phenyl]-N-pyridin-3-ylpyrazine-2-carboxamide;benzoic acid
CID 66678813
3-[5-amino-6-(methylcarbamoyl)pyrazin-2-yl]benzoic acid;3-amino-N-methyl-6-[3-[(4-morpholin-4-ylphenyl)methylcarbamoyl]phenyl]pyrazine-2-carboxamide;(4-morpholin-4-ylphenyl)methanamine;(4-morpholin-4-ylphenyl)methanol
CID 157078520
3-amino-N,6-diphenylpyrazine-2-carboxamide;3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;3-amino-6-[4-(hydroxymethyl)phenyl]-N-phenylpyrazine-2-carboxamide;3-amino-6-(4-morpholin-4-ylphenyl)-N-phenylpyrazine-2-carboxamide;molecular hydrogen
CID 157216428
3-amino-6-[4-(hydroxymethyl)phenyl]-N-phenylpyrazine-2-carboxamide;molecular hydrogen
CID 157329850

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
The IUPAC name of 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen (CID 159300646) is 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen.
What is the SMILES notation for 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
The canonical SMILES for 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen is Cc1ncc(-c2ccc(CO)cc2)nc1C(=O)Nc1ccccc1.Cc1ncc(-c2ccc(N3CCCCC3)cc2)nc1C(=O)Nc1ccccc1.Nc1ncc(-c2ccccc2F)nc1C(=O)Nc1ccccc1.[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
The InChIKey is LBHDWNIYNHFOAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N4O.C19H17N3O2.C17H13FN4O.7H2/c1-17-22(23(28)25-19-8-4-2-5-9-19)26-21(16-24-17)18-10-12-20(13-11-18)27-14-6-3-7-15-27;1-13-18(19(24)21-16-5-3-2-4-6-16)22-17(11-20-13)15-9-7-14(12-23)8-10-15;18-13-9-5-4-8-12(13)14-10-20-16(19)15(22-14)17(23)21-11-6-2-1-3-7-11;;;;;;;/h2,4-5,8-13,16H,3,6-7,14-15H2,1H3,(H,25,28);2-11,23H,12H2,1H3,(H,21,24);1-10H,(H2,19,20)(H,21,23);7*1H.
What are the key properties of 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen?
3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen has a molecular weight of 1014.26 g/mol, XLogP of 12.73, 11 rotatable bonds, 5 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(2-fluorophenyl)-N-phenylpyrazine-2-carboxamide;6-[4-(hydroxymethyl)phenyl]-3-methyl-N-phenylpyrazine-2-carboxamide;3-methyl-N-phenyl-6-(4-piperidin-1-ylphenyl)pyrazine-2-carboxamide;molecular hydrogen is sourced from PubChem (CID 159300646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).