3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one

C24H26N4O — CID 1433133

IUPAC3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one
SMILESCc1ccc2nc(-c3cc4ccc(C)c(C)c4[nH]c3=O)c(NC3CCCC3)n2c1
InChIInChI=1S/C24H26N4O/c1-14-8-11-20-26-22(23(28(20)13-14)25-18-6-4-5-7-18)19-12-17-10-9-15(2)16(3)21(17)27-24(19)29/h8-13,18,25H,4-7H2,1-3H3,(H,27,29)
InChIKeySSKJUAKBBBQLBH-UHFFFAOYSA-N
MW386.50 g/mol
LogP5.12
Rot. Bonds3

About 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one

3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one (PubChem CID 1433133) has the molecular formula C24H26N4O and a molecular weight of 386.50 g/mol. Its IUPAC name is 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one.

Molecular Properties

Compound Name3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one
PubChem CID1433133
Molecular FormulaC24H26N4O
Molecular Weight386.50 g/mol
Exact Mass386.21
IUPAC Name3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one
SMILESCc1ccc2nc(-c3cc4ccc(C)c(C)c4[nH]c3=O)c(NC3CCCC3)n2c1
InChIInChI=1S/C24H26N4O/c1-14-8-11-20-26-22(23(28(20)13-14)25-18-6-4-5-7-18)19-12-17-10-9-15(2)16(3)21(17)27-24(19)29/h8-13,18,25H,4-7H2,1-3H3,(H,27,29)
InChIKeySSKJUAKBBBQLBH-UHFFFAOYSA-N
XLogP5.12
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.50
LogP ≤ 55.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one?
The IUPAC name of 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one (CID 1433133) is 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one.
What is the SMILES notation for 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one?
The canonical SMILES for 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one is Cc1ccc2nc(-c3cc4ccc(C)c(C)c4[nH]c3=O)c(NC3CCCC3)n2c1.
What is the InChIKey of 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one?
The InChIKey is SSKJUAKBBBQLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O/c1-14-8-11-20-26-22(23(28(20)13-14)25-18-6-4-5-7-18)19-12-17-10-9-15(2)16(3)21(17)27-24(19)29/h8-13,18,25H,4-7H2,1-3H3,(H,27,29).
What are the key properties of 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one?
3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one has a molecular weight of 386.50 g/mol, XLogP of 5.12, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(cyclopentylamino)-6-methylimidazo[1,2-a]pyridin-2-yl]-7,8-dimethyl-1H-quinolin-2-one is sourced from PubChem (CID 1433133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).