3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine

C87H69Cl2N29O3 — CID 159866813

IUPAC3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine
SMILESCc1cc(-c2ncc(N)nc2-c2ccn(C)n2)cc2cccnc12.Cn1ccc(-c2nc(N)cnc2-c2ccc3[nH]c(=O)ccc3c2)n1.Cn1ccc(-c2nc(N)cnc2-c2ccc3c(=O)cc[nH]c3c2)n1.Cn1ncc(-c2nc(N)cnc2-c2cc(Cl)c3ncccc3c2)n1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)[nH]c1=O
InChIInChI=1S/C19H13ClN4O.C18H16N6.2C17H14N6O.C16H12ClN7/c20-14-10-13(9-12-7-4-8-22-15(12)14)17-16(11-5-2-1-3-6-11)23-18(21)19(25)24-17;1-11-8-13(9-12-4-3-6-20-16(11)12)17-18(22-15(19)10-21-17)14-5-7-24(2)23-14;1-23-7-6-13(22-23)17-16(19-9-14(18)21-17)11-2-4-12-10(8-11)3-5-15(24)20-12;1-23-7-5-12(22-23)17-16(20-9-15(18)21-17)10-2-3-11-13(8-10)19-6-4-14(11)24;1-24-21-7-12(23-24)16-15(20-8-13(18)22-16)10-5-9-3-2-4-19-14(9)11(17)6-10/h1-10H,(H2,21,23)(H,24,25);3-10H,1-2H3,(H2,19,22);2-9H,1H3,(H2,18,21)(H,20,24);2-9H,1H3,(H2,18,21)(H,19,24);2-8H,1H3,(H2,18,22)
InChIKeyNRVHSKMHHZYGQW-UHFFFAOYSA-N
MW1639.61 g/mol
LogP13.53
Rot. Bonds10

About 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine

3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine (PubChem CID 159866813) has the molecular formula C87H69Cl2N29O3 and a molecular weight of 1639.61 g/mol. Its IUPAC name is 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine.

Molecular Properties

Compound Name3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine
PubChem CID159866813
Molecular FormulaC87H69Cl2N29O3
Molecular Weight1639.61 g/mol
Exact Mass1637.55
IUPAC Name3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine
SMILESCc1cc(-c2ncc(N)nc2-c2ccn(C)n2)cc2cccnc12.Cn1ccc(-c2nc(N)cnc2-c2ccc3[nH]c(=O)ccc3c2)n1.Cn1ccc(-c2nc(N)cnc2-c2ccc3c(=O)cc[nH]c3c2)n1.Cn1ncc(-c2nc(N)cnc2-c2cc(Cl)c3ncccc3c2)n1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)[nH]c1=O
InChIInChI=1S/C19H13ClN4O.C18H16N6.2C17H14N6O.C16H12ClN7/c20-14-10-13(9-12-7-4-8-22-15(12)14)17-16(11-5-2-1-3-6-11)23-18(21)19(25)24-17;1-11-8-13(9-12-4-3-6-20-16(11)12)17-18(22-15(19)10-21-17)14-5-7-24(2)23-14;1-23-7-6-13(22-23)17-16(19-9-14(18)21-17)11-2-4-12-10(8-11)3-5-15(24)20-12;1-23-7-5-12(22-23)17-16(20-9-15(18)21-17)10-2-3-11-13(8-10)19-6-4-14(11)24;1-24-21-7-12(23-24)16-15(20-8-13(18)22-16)10-5-9-3-2-4-19-14(9)11(17)6-10/h1-10H,(H2,21,23)(H,24,25);3-10H,1-2H3,(H2,19,22);2-9H,1H3,(H2,18,21)(H,20,24);2-9H,1H3,(H2,18,21)(H,19,24);2-8H,1H3,(H2,18,22)
InChIKeyNRVHSKMHHZYGQW-UHFFFAOYSA-N
XLogP13.53
TPSA467.53 Ų
H-Bond Donors8
H-Bond Acceptors29
Rotatable Bonds10
Heavy Atoms121
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001639.61
LogP ≤ 513.53
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1029

Analyze 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine with MolForge

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Related Compounds

N-[[4-[3-(3-chloro-4-isocyanophenyl)pyrazol-1-yl]-2-fluorophenyl]methyl]-1H-indole-5-carboxamide;N-[[4-[4-(3-chloro-4-isocyanophenyl)pyrazol-1-yl]-2-fluorophenyl]methyl]-1H-indole-5-carboxamide;N-[[4-[1-(5-chloro-6-isocyano-3-pyridinyl)-3,5-dimethylpyrazol-4-yl]-2-fluorophenyl]methyl]-1H-indole-5-carboxamide;N-[[4-[1-(5-chloro-6-isocyano-3-pyridinyl)pyrazol-4-yl]-2-fluorophenyl]methyl]-1H-indole-5-carboxamide;N-[[4-[3-(5-chloro-6-isocyano-3-pyridinyl)pyrazol-1-yl]-2-fluorophenyl]methyl]-1H-indole-5-carboxamide;N-[[2-fluoro-4-[3-[4-isocyano-3-(trifluoromethyl)phenyl]pyrazol-1-yl]phenyl]methyl]-1H-indole-5-carboxamide;N-[[2-fluoro-4-[4-[4-isocyano-3-(trifluoromethyl)phenyl]pyrazol-1-yl]phenyl]methyl]-1H-indole-5-carboxamide;N-[[2-fluoro-4-[3-[6-isocyano-5-(trifluoromethyl)-3-pyridinyl]pyrazol-1-yl]phenyl]methyl]-1H-indole-5-carboxamide
CID 161869160
2-chloro-N-(2-pyrrolidin-1-ylethyl)-4-[3-(quinolin-7-ylmethyl)triazolo[4,5-b]pyridin-5-yl]benzamide;N-[3-(methylamino)-3-oxopropyl]-4-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridin-5-yl]benzamide
CID 118420596
[2-[5-[2-[[(5-Chloro-2-pyridinyl)amino]methyl]-3-methyl-1-[5-methyl-2-(4-methyltriazol-2-yl)benzoyl]piperidin-4-yl]-3-methylpyrazol-1-yl]-5-methylphenyl]-[2-[[(5-chloro-2-pyridinyl)amino]methyl]-3-methylpiperidin-1-yl]methanone
CID 123771632
[3-Amino-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazin-2-yl]-(4-methylphenyl)methanone
CID 137431566
2-chloro-N-[3-(methylamino)-3-oxopropyl]-N-(2-pyrrolidin-1-ylethyl)-4-[3-(quinolin-7-ylmethyl)triazolo[4,5-b]pyridin-5-yl]-3-[[4-[3-(quinolin-6-ylmethyl)triazolo[4,5-b]pyridin-5-yl]benzoyl]amino]benzamide
CID 140296371
6-[8-chloro-3-[3-[3-[2-chloro-6-[[3-[3-(2-chloro-6-methyl-4-pyridinyl)-7-[(3-methylpyrrol-1-yl)methyl]-5-oxo-8H-1,8-naphthyridin-2-yl]phenyl]methyl]-4-pyridinyl]-6-[(4-methylphenyl)methyl]-5-oxo-8H-1,8-naphthyridin-2-yl]phenyl]quinolin-6-yl]-3-methyl-7-phenyl-1H-1,8-naphthyridin-2-one
CID 155170992
3-amino-6-[3-[[3-[5-amino-2-(8-chloroquinolin-6-yl)-6-oxo-1H-pyrazin-3-yl]pyrazol-1-yl]methyl]-8-chloroquinolin-6-yl]-5-(1-methylpyrazol-3-yl)pyrazine-2-carboxamide
CID 156450004
bis(N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-3-(aminomethyl)-1-[(3-chloroquinolin-6-yl)methyl]pyrazole-4-carboxamide);N-[(6-amino-2,4-dimethyl-3-pyridinyl)methyl]-1-[(3-chloroquinolin-6-yl)methyl]-3-cyanopyrazole-4-carboxamide;N,N-diethylethanamine
CID 157287819
N-(2-chlorophenyl)-2-[1-[3-[2-(2,6-dimethyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[2-fluoro-5-[2-(6-methyl-3-pyridinyl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-[2-(2-methylindazol-5-yl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-[2-(1,5-naphthyridin-4-yl)acetyl]phenyl]pyrazol-4-yl]acetamide;N-(2-chlorophenyl)-2-[1-[3-[2-(2-oxo-1,3-dihydroindol-5-yl)acetyl]phenyl]pyrazol-4-yl]acetamide;1-[3-[4-[2-(1,3-dihydroisoindol-2-yl)-2-oxoethyl]pyrazol-1-yl]phenyl]-2-(2-methyl-4-pyridinyl)ethanone
CID 157291163
1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-3-[2-(diethylamino)ethyl]urea;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-3-(4-methylphenyl)urea;1-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-3-(6-methyl-3-pyridinyl)urea;N-[3-amino-6-(7-chloro-1H-indazol-5-yl)-5-phenylpyrazin-2-yl]-1-methylpyrrole-3-carboxamide
CID 157312784
3-(benzylamino)-6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;N-[5-(8-chloroquinolin-6-yl)-3-cyano-6-(1-methylpyrazol-3-yl)pyrazin-2-yl]acetamide;6-(8-chloroquinolin-6-yl)-3-[(4-methylphenyl)methylamino]-5-(1-methylpyrazol-3-yl)pyrazine-2-carbonitrile;6-(8-chloroquinolin-6-yl)-5-(1-methylpyrazol-3-yl)-3-(2-phenylethylamino)pyrazine-2-carbonitrile
CID 157383580
6-(8-chloro-4-fluoroquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-2-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-2-methylquinolin-6-yl)-7-(3-methylpyrazol-1-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-3-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-5-methylquinolin-6-yl)-7-(1-methylpyrazol-3-yl)-1H-1,8-naphthyridin-4-one;6-(8-chloro-5-methylquinolin-6-yl)-7-phenyl-1H-1,8-naphthyridin-2-one
CID 157399566

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine?
The IUPAC name of 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine (CID 159866813) is 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine.
What is the SMILES notation for 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine?
The canonical SMILES for 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine is Cc1cc(-c2ncc(N)nc2-c2ccn(C)n2)cc2cccnc12.Cn1ccc(-c2nc(N)cnc2-c2ccc3[nH]c(=O)ccc3c2)n1.Cn1ccc(-c2nc(N)cnc2-c2ccc3c(=O)cc[nH]c3c2)n1.Cn1ncc(-c2nc(N)cnc2-c2cc(Cl)c3ncccc3c2)n1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3ncccc3c2)[nH]c1=O.
What is the InChIKey of 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine?
The InChIKey is NRVHSKMHHZYGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13ClN4O.C18H16N6.2C17H14N6O.C16H12ClN7/c20-14-10-13(9-12-7-4-8-22-15(12)14)17-16(11-5-2-1-3-6-11)23-18(21)19(25)24-17;1-11-8-13(9-12-4-3-6-20-16(11)12)17-18(22-15(19)10-21-17)14-5-7-24(2)23-14;1-23-7-6-13(22-23)17-16(19-9-14(18)21-17)11-2-4-12-10(8-11)3-5-15(24)20-12;1-23-7-5-12(22-23)17-16(20-9-15(18)21-17)10-2-3-11-13(8-10)19-6-4-14(11)24;1-24-21-7-12(23-24)16-15(20-8-13(18)22-16)10-5-9-3-2-4-19-14(9)11(17)6-10/h1-10H,(H2,21,23)(H,24,25);3-10H,1-2H3,(H2,19,22);2-9H,1H3,(H2,18,21)(H,20,24);2-9H,1H3,(H2,18,21)(H,19,24);2-8H,1H3,(H2,18,22).
What are the key properties of 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine?
3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine has a molecular weight of 1639.61 g/mol, XLogP of 13.53, 10 rotatable bonds, 8 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(8-chloroquinolin-6-yl)-5-phenyl-1H-pyrazin-2-one;6-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-2-one;7-[5-amino-3-(1-methylpyrazol-3-yl)pyrazin-2-yl]-1H-quinolin-4-one;5-(8-chloroquinolin-6-yl)-6-(2-methyltriazol-4-yl)pyrazin-2-amine;6-(1-methylpyrazol-3-yl)-5-(8-methylquinolin-6-yl)pyrazin-2-amine is sourced from PubChem (CID 159866813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).