2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one

C26H16ClN5O2 — CID 154656943

IUPAC2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCc1ccc(-c2nc3[nH]c(=O)c(-c4ccncc4)cc3nc2-c2cc(Cl)c3ncccc3c2)o1
InChIInChI=1S/C26H16ClN5O2/c1-14-4-5-21(34-14)24-23(17-11-16-3-2-8-29-22(16)19(27)12-17)30-20-13-18(15-6-9-28-10-7-15)26(33)32-25(20)31-24/h2-13H,1H3,(H,31,32,33)
InChIKeyBNNWXPSDWXKQNW-UHFFFAOYSA-N
MW465.90 g/mol
LogP5.82
Rot. Bonds3

About 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one

2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one (PubChem CID 154656943) has the molecular formula C26H16ClN5O2 and a molecular weight of 465.90 g/mol. Its IUPAC name is 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one.

Molecular Properties

Compound Name2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one
PubChem CID154656943
Molecular FormulaC26H16ClN5O2
Molecular Weight465.90 g/mol
Exact Mass465.10
IUPAC Name2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one
SMILESCc1ccc(-c2nc3[nH]c(=O)c(-c4ccncc4)cc3nc2-c2cc(Cl)c3ncccc3c2)o1
InChIInChI=1S/C26H16ClN5O2/c1-14-4-5-21(34-14)24-23(17-11-16-3-2-8-29-22(16)19(27)12-17)30-20-13-18(15-6-9-28-10-7-15)26(33)32-25(20)31-24/h2-13H,1H3,(H,31,32,33)
InChIKeyBNNWXPSDWXKQNW-UHFFFAOYSA-N
XLogP5.82
TPSA97.56 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500465.90
LogP ≤ 55.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one with MolForge

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Related Compounds

4-(2-Amino-3-((3-chloro-4-fluorophenyl) amino)furo[2,3-c]pyridin-7-yl)-N-(pyridin-2-yl)picolinamide
CID 117704885
US9670212, 58 3-amino-N-[(8-methyl-2-{4-[(5-methylfuran-2-yl)methyl]-1,4-diazepan-1-yl}quinolin-3-yl)methyl]pyrazine-2-carboxamide
CID 56945079
US11685745, Example 480
CID 137416266
US11685745, Example 543
CID 137416373
US11685745, Example 311
CID 137416661
N-[5-(3-chloro-4-fluorophenyl)-6-(furan-2-yl)pyrazin-2-yl]-2-[4-(dimethylamino)phenyl]acetamide
CID 172438318
3-(4-Fluorophenoxy)-6-(5-methylfuran-2-yl)-5-quinolin-6-ylpyrazin-2-amine
CID 137430207
2-N-[(4-fluorophenyl)methyl]-5-(5-methylfuran-2-yl)-6-quinolin-6-ylpyrazine-2,3-diamine
CID 137430209
2-N-(4-fluorophenyl)-5-(5-methylfuran-2-yl)-6-quinolin-6-ylpyrazine-2,3-diamine
CID 137430211
N-[6-[5-amino-6-cyano-3-(5-methylfuran-2-yl)pyrazin-2-yl]quinolin-4-yl]-4-fluorobenzamide
CID 137430647
3-Amino-6-[4-[(4-fluorophenyl)methylamino]quinolin-6-yl]-5-(5-methylfuran-2-yl)pyrazine-2-carbonitrile
CID 137430648
3-Fluoro-6-(5-methylfuran-2-yl)-5-quinolin-6-ylpyrazin-2-amine
CID 137431557

Frequently Asked Questions

What is the IUPAC name of 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The IUPAC name of 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one (CID 154656943) is 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one.
What is the SMILES notation for 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The canonical SMILES for 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one is Cc1ccc(-c2nc3[nH]c(=O)c(-c4ccncc4)cc3nc2-c2cc(Cl)c3ncccc3c2)o1.
What is the InChIKey of 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one?
The InChIKey is BNNWXPSDWXKQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H16ClN5O2/c1-14-4-5-21(34-14)24-23(17-11-16-3-2-8-29-22(16)19(27)12-17)30-20-13-18(15-6-9-28-10-7-15)26(33)32-25(20)31-24/h2-13H,1H3,(H,31,32,33).
What are the key properties of 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one?
2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one has a molecular weight of 465.90 g/mol, XLogP of 5.82, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-chloroquinolin-6-yl)-3-(5-methylfuran-2-yl)-7-pyridin-4-yl-5H-pyrido[2,3-b]pyrazin-6-one is sourced from PubChem (CID 154656943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).