4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one

C24H23N5O2 — CID 176506848

IUPAC4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one
SMILESO=C(c1cnc2c(c1)ncn2Cc1ccccc1)N1CCC(c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C24H23N5O2/c30-22-13-19(6-9-25-22)18-7-10-28(11-8-18)24(31)20-12-21-23(26-14-20)29(16-27-21)15-17-4-2-1-3-5-17/h1-6,9,12-14,16,18H,7-8,10-11,15H2,(H,25,30)
InChIKeyQFSBJBDPLRUTEL-UHFFFAOYSA-N
MW413.48 g/mol
LogP3.19
Rot. Bonds4

About 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one

4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one (PubChem CID 176506848) has the molecular formula C24H23N5O2 and a molecular weight of 413.48 g/mol. Its IUPAC name is 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one.

Molecular Properties

Compound Name4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one
PubChem CID176506848
Molecular FormulaC24H23N5O2
Molecular Weight413.48 g/mol
Exact Mass413.19
IUPAC Name4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one
SMILESO=C(c1cnc2c(c1)ncn2Cc1ccccc1)N1CCC(c2cc[nH]c(=O)c2)CC1
InChIInChI=1S/C24H23N5O2/c30-22-13-19(6-9-25-22)18-7-10-28(11-8-18)24(31)20-12-21-23(26-14-20)29(16-27-21)15-17-4-2-1-3-5-17/h1-6,9,12-14,16,18H,7-8,10-11,15H2,(H,25,30)
InChIKeyQFSBJBDPLRUTEL-UHFFFAOYSA-N
XLogP3.19
TPSA83.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.48
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one with MolForge

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Related Compounds

N-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)pyrrolidin-3-yl]acetamide
CID 176505536
[4-(4-methyl-1,2,4-triazol-3-yl)piperidin-1-yl]-[3-(2-phenylethyl)imidazo[4,5-b]pyridin-6-yl]methanone
CID 176504399
2-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)-6-oxa-2,9-diazaspiro[4.5]decan-8-one
CID 176500676
(3-methylimidazo[4,5-b]pyridin-6-yl)-(3-phenylpyrrolidin-1-yl)methanone
CID 154860646
(3-benzylimidazo[4,5-b]pyridin-6-yl)-[(1R,5S)-3-(hydroxymethyl)-8-azabicyclo[3.2.1]octan-8-yl]methanone
CID 176501949
[3-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridin-6-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 175641326
4-(4-benzylpiperazine-1-carbonyl)-1H-pyridin-2-one
CID 110600792
3-benzyl-N-(3-hydroxycyclobutyl)imidazo[4,5-b]pyridine-6-carboxamide
CID 176506320
4-[1-(2-ethylbenzoyl)piperidin-4-yl]-1H-pyridin-2-one
CID 138807182
(3-methoxypyrrolidin-1-yl)-[3-(pyridin-2-ylmethyl)imidazo[4,5-b]pyridin-6-yl]methanone
CID 176505470
[(3aR,4R,5S,6aR)-4,5-bis(hydroxymethyl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl]-[3-(2-phenylethyl)imidazo[4,5-b]pyridin-6-yl]methanone
CID 176505777
[3-(pyridin-3-ylmethyl)imidazo[4,5-b]pyridin-6-yl]-[2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methanone
CID 176505498

Frequently Asked Questions

What is the IUPAC name of 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one?
The IUPAC name of 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one (CID 176506848) is 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one.
What is the SMILES notation for 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one?
The canonical SMILES for 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one is O=C(c1cnc2c(c1)ncn2Cc1ccccc1)N1CCC(c2cc[nH]c(=O)c2)CC1.
What is the InChIKey of 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one?
The InChIKey is QFSBJBDPLRUTEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N5O2/c30-22-13-19(6-9-25-22)18-7-10-28(11-8-18)24(31)20-12-21-23(26-14-20)29(16-27-21)15-17-4-2-1-3-5-17/h1-6,9,12-14,16,18H,7-8,10-11,15H2,(H,25,30).
What are the key properties of 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one?
4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one has a molecular weight of 413.48 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(3-benzylimidazo[4,5-b]pyridine-6-carbonyl)piperidin-4-yl]-1H-pyridin-2-one is sourced from PubChem (CID 176506848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).