6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one

C22H16N4OS — CID 154656740

IUPAC6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESCc1cc(=O)c2nc(-c3ccc4ncccc4c3)c(-c3ccc(C)s3)nc2[nH]1
InChIInChI=1S/C22H16N4OS/c1-12-10-17(27)20-22(24-12)26-21(18-8-5-13(2)28-18)19(25-20)15-6-7-16-14(11-15)4-3-9-23-16/h3-11H,1-2H3,(H,24,26,27)
InChIKeyJYUHRLIVMTZJFG-UHFFFAOYSA-N
MW384.46 g/mol
LogP4.88
Rot. Bonds2

About 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one

6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one (PubChem CID 154656740) has the molecular formula C22H16N4OS and a molecular weight of 384.46 g/mol. Its IUPAC name is 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one.

Molecular Properties

Compound Name6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one
PubChem CID154656740
Molecular FormulaC22H16N4OS
Molecular Weight384.46 g/mol
Exact Mass384.10
IUPAC Name6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one
SMILESCc1cc(=O)c2nc(-c3ccc4ncccc4c3)c(-c3ccc(C)s3)nc2[nH]1
InChIInChI=1S/C22H16N4OS/c1-12-10-17(27)20-22(24-12)26-21(18-8-5-13(2)28-18)19(25-20)15-6-7-16-14(11-15)4-3-9-23-16/h3-11H,1-2H3,(H,24,26,27)
InChIKeyJYUHRLIVMTZJFG-UHFFFAOYSA-N
XLogP4.88
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one with MolForge

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Launch Full Analysis

Related Compounds

3-(5-methylthiophen-2-yl)-7-pyrimidin-5-yl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154657489
3-(5-methylthiophen-2-yl)-7-(2-oxo-1-pyridinyl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154656404
7-(5-methylthiophen-2-yl)-2-oxo-6-quinolin-6-yl-1H-1,8-naphthyridine-4-carboxamide
CID 137438841
3-(2-methyl-1H-imidazol-5-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one
CID 154657357
7-(5-methylthiophen-2-yl)-3-morpholin-4-yl-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
CID 137438139
N-benzyl-8-oxo-3-phenyl-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazine-6-carboxamide
CID 154657440
N-benzyl-7-(5-methylthiophen-2-yl)-4-oxo-6-quinolin-6-yl-1H-1,8-naphthyridine-2-carboxamide
CID 137438794
7-(5-methylthiophen-2-yl)-2-(3-phenylpropanoyl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 153147691
7-(5-methyl-1H-pyrrol-2-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-4-one
CID 137438504
3-hydroxy-7-(2-methyl-1,3-thiazol-5-yl)-6-quinolin-6-yl-1H-1,8-naphthyridin-2-one
CID 137438827
N-methyl-1-(5-quinolin-6-ylthiophen-2-yl)methanamine
CID 62635117
7-[2-(diethylamino)ethylamino]-3-(2-methyl-1,3-thiazol-5-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-6-one
CID 154657593

Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one?
The IUPAC name of 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one (CID 154656740) is 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one.
What is the SMILES notation for 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one?
The canonical SMILES for 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one is Cc1cc(=O)c2nc(-c3ccc4ncccc4c3)c(-c3ccc(C)s3)nc2[nH]1.
What is the InChIKey of 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one?
The InChIKey is JYUHRLIVMTZJFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N4OS/c1-12-10-17(27)20-22(24-12)26-21(18-8-5-13(2)28-18)19(25-20)15-6-7-16-14(11-15)4-3-9-23-16/h3-11H,1-2H3,(H,24,26,27).
What are the key properties of 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one?
6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one has a molecular weight of 384.46 g/mol, XLogP of 4.88, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-(5-methylthiophen-2-yl)-2-quinolin-6-yl-5H-pyrido[2,3-b]pyrazin-8-one is sourced from PubChem (CID 154656740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).