3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one

C18H24N4O2 — CID 171141982

IUPAC3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one
SMILESCn1c(=O)n(C2CCCN(C(=O)C3CCCC3)C2)c2ncccc21
InChIInChI=1S/C18H24N4O2/c1-20-15-9-4-10-19-16(15)22(18(20)24)14-8-5-11-21(12-14)17(23)13-6-2-3-7-13/h4,9-10,13-14H,2-3,5-8,11-12H2,1H3
InChIKeyCATVAMPJSAQUGK-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.09
Rot. Bonds2

About 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one

3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one (PubChem CID 171141982) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one
PubChem CID171141982
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one
SMILESCn1c(=O)n(C2CCCN(C(=O)C3CCCC3)C2)c2ncccc21
InChIInChI=1S/C18H24N4O2/c1-20-15-9-4-10-19-16(15)22(18(20)24)14-8-5-11-21(12-14)17(23)13-6-2-3-7-13/h4,9-10,13-14H,2-3,5-8,11-12H2,1H3
InChIKeyCATVAMPJSAQUGK-UHFFFAOYSA-N
XLogP2.09
TPSA60.13 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one (CID 171141982) is 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one is Cn1c(=O)n(C2CCCN(C(=O)C3CCCC3)C2)c2ncccc21.
What is the InChIKey of 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one?
The InChIKey is CATVAMPJSAQUGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-20-15-9-4-10-19-16(15)22(18(20)24)14-8-5-11-21(12-14)17(23)13-6-2-3-7-13/h4,9-10,13-14H,2-3,5-8,11-12H2,1H3.
What are the key properties of 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one?
3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one has a molecular weight of 328.42 g/mol, XLogP of 2.09, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(cyclopentanecarbonyl)piperidin-3-yl]-1-methylimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 171141982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).