3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid

C112H86N28O5 — CID 159797269

IUPAC3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid
SMILESCC(N)c1cccc(C#N)n1.CC(NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.C[C@@H](NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.C[C@H](NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.Nc1nc(-c2ccccc2)c(-c2ccc3ncccc3c2)nc1C(=O)O
InChIInChI=1S/3C28H21N7O.C20H14N4O2.C8H9N3/c3*1-17(22-11-5-10-21(16-29)33-22)32-28(36)26-27(30)35-24(18-7-3-2-4-8-18)25(34-26)20-12-13-23-19(15-20)9-6-14-31-23;21-19-18(20(25)26)23-17(16(24-19)12-5-2-1-3-6-12)14-8-9-15-13(11-14)7-4-10-22-15;1-6(10)8-4-2-3-7(5-9)11-8/h3*2-15,17H,1H3,(H2,30,35)(H,32,36);1-11H,(H2,21,24)(H,25,26);2-4,6H,10H2,1H3/t2*17-;;;/m10.../s1
InChIKeyNJIHTSDMAWONQT-POMOXLBYSA-N
MW1904.11 g/mol
LogP18.71
Rot. Bonds19

About 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid

3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid (PubChem CID 159797269) has the molecular formula C112H86N28O5 and a molecular weight of 1904.11 g/mol. Its IUPAC name is 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid.

Molecular Properties

Compound Name3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid
PubChem CID159797269
Molecular FormulaC112H86N28O5
Molecular Weight1904.11 g/mol
Exact Mass1902.73
IUPAC Name3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid
SMILESCC(N)c1cccc(C#N)n1.CC(NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.C[C@@H](NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.C[C@H](NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.Nc1nc(-c2ccccc2)c(-c2ccc3ncccc3c2)nc1C(=O)O
InChIInChI=1S/3C28H21N7O.C20H14N4O2.C8H9N3/c3*1-17(22-11-5-10-21(16-29)33-22)32-28(36)26-27(30)35-24(18-7-3-2-4-8-18)25(34-26)20-12-13-23-19(15-20)9-6-14-31-23;21-19-18(20(25)26)23-17(16(24-19)12-5-2-1-3-6-12)14-8-9-15-13(11-14)7-4-10-22-15;1-6(10)8-4-2-3-7(5-9)11-8/h3*2-15,17H,1H3,(H2,30,35)(H,32,36);1-11H,(H2,21,24)(H,25,26);2-4,6H,10H2,1H3/t2*17-;;;/m10.../s1
InChIKeyNJIHTSDMAWONQT-POMOXLBYSA-N
XLogP18.71
TPSA556.10 Ų
H-Bond Donors9
H-Bond Acceptors29
Rotatable Bonds19
Heavy Atoms145
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001904.11
LogP ≤ 518.71
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1029

Analyze 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-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

3-amino-N-[(6-cyano-2-pyridinyl)methyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604675
3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604487
3-amino-5-(3-cyanophenyl)-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604568
3-amino-5-(3-cyanophenyl)-N-[(1S)-1-pyridin-2-ylethyl]-6-quinolin-6-ylpyrazine-2-carboxamide
CID 164607280
3-amino-5-(3-cyanophenyl)-N-[1-(5-fluoro-2-pyridinyl)ethyl]-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604353
3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-6-(3-fluoroquinolin-6-yl)-5-phenylpyrazine-2-carboxamide
CID 154604520
3-amino-5-(3-cyanophenyl)-6-(3-fluoroquinolin-6-yl)-N-[(1R)-1-pyridin-2-ylethyl]pyrazine-2-carboxamide
CID 154604566
3-amino-N-[(6-cyano-2-pyridinyl)methyl]-6-(3-fluoroquinolin-6-yl)-5-phenylpyrazine-2-carboxamide
CID 154656230
3-[[(1R)-1-[2-cyano-3-(4,4-difluoropiperidin-1-yl)-7-methylquinoxalin-5-yl]ethyl]amino]pyrazine-2-carboxylic acid
CID 172522116
3-amino-5-phenyl-6-(6-quinolinyl)-2-Pyrazinecarboxylic acid
CID 137423701
3-amino-5-(3-cyanophenyl)-N-[1-(6-cyano-2-pyridinyl)ethyl]-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604329
3-amino-5-phenyl-N-(1-pyridin-2-ylethyl)-6-quinolin-6-ylpyrazine-2-carboxamide
CID 154604340

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid?
The IUPAC name of 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid (CID 159797269) is 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid.
What is the SMILES notation for 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid?
The canonical SMILES for 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid is CC(N)c1cccc(C#N)n1.CC(NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.C[C@@H](NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.C[C@H](NC(=O)c1nc(-c2ccc3ncccc3c2)c(-c2ccccc2)nc1N)c1cccc(C#N)n1.Nc1nc(-c2ccccc2)c(-c2ccc3ncccc3c2)nc1C(=O)O.
What is the InChIKey of 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid?
The InChIKey is NJIHTSDMAWONQT-POMOXLBYSA-N. The full InChI is InChI=1S/3C28H21N7O.C20H14N4O2.C8H9N3/c3*1-17(22-11-5-10-21(16-29)33-22)32-28(36)26-27(30)35-24(18-7-3-2-4-8-18)25(34-26)20-12-13-23-19(15-20)9-6-14-31-23;21-19-18(20(25)26)23-17(16(24-19)12-5-2-1-3-6-12)14-8-9-15-13(11-14)7-4-10-22-15;1-6(10)8-4-2-3-7(5-9)11-8/h3*2-15,17H,1H3,(H2,30,35)(H,32,36);1-11H,(H2,21,24)(H,25,26);2-4,6H,10H2,1H3/t2*17-;;;/m10.../s1.
What are the key properties of 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid?
3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid has a molecular weight of 1904.11 g/mol, XLogP of 18.71, 19 rotatable bonds, 9 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[(1R)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[(1S)-1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;3-amino-N-[1-(6-cyano-2-pyridinyl)ethyl]-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxamide;6-(1-aminoethyl)pyridine-2-carbonitrile;3-amino-5-phenyl-6-quinolin-6-ylpyrazine-2-carboxylic acid is sourced from PubChem (CID 159797269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).