5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one

C19H20N4O2 — CID 136541158

IUPAC5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESO=C(c1ccc2[nH]c(=O)[nH]c2n1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C19H20N4O2/c24-18(16-7-6-15-17(20-16)22-19(25)21-15)23-10-8-14(9-11-23)12-13-4-2-1-3-5-13/h1-7,14H,8-12H2,(H2,20,21,22,25)
InChIKeyCUXGKYWXGTWDGB-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.35
Rot. Bonds3

About 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one

5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one (PubChem CID 136541158) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one
PubChem CID136541158
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one
SMILESO=C(c1ccc2[nH]c(=O)[nH]c2n1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C19H20N4O2/c24-18(16-7-6-15-17(20-16)22-19(25)21-15)23-10-8-14(9-11-23)12-13-4-2-1-3-5-13/h1-7,14H,8-12H2,(H2,20,21,22,25)
InChIKeyCUXGKYWXGTWDGB-UHFFFAOYSA-N
XLogP2.35
TPSA81.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydrobenzimidazol-2-one
CID 110692348
6-(4-benzylpiperidine-1-carbonyl)-4H-pyrido[3,2-b][1,4]oxazin-3-one
CID 138688286
6-(4-benzylpiperidine-1-carbonyl)-N-propan-2-ylpyridine-2-carboxamide
CID 109093691
(4-benzylpiperidin-1-yl)-phenylmethanone
CID 796596
[2-(4-benzylpiperidin-1-yl)pyrimidin-4-yl]-pyrrolidin-1-ylmethanone
CID 109297729
3-(4-benzylpiperidine-1-carbonyl)-5,6-dimethyl-1H-pyrazin-2-one
CID 154795486
(4-benzylpiperidin-1-yl)-[2-(4-methylpiperazin-1-yl)pyrimidin-4-yl]methanone
CID 109302082
(4-benzylpiperidin-1-yl)-[5-(propan-2-ylamino)-2-pyridinyl]methanone
CID 109179716
[4-(benzylamino)-2-pyridinyl]-(4-benzylpiperidin-1-yl)methanone
CID 109209814
(4-benzylpiperidin-1-yl)-(4,5-dimethyl-1H-pyrazol-3-yl)methanone
CID 110855772
(4-benzylpiperidin-1-yl)-(1,5-dimethylpyrazol-3-yl)methanone
CID 110685777
(4-benzylpiperidin-1-yl)-(2-phenyltriazol-4-yl)methanone
CID 110702375

Frequently Asked Questions

What is the IUPAC name of 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The IUPAC name of 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one (CID 136541158) is 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one is O=C(c1ccc2[nH]c(=O)[nH]c2n1)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
The InChIKey is CUXGKYWXGTWDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c24-18(16-7-6-15-17(20-16)22-19(25)21-15)23-10-8-14(9-11-23)12-13-4-2-1-3-5-13/h1-7,14H,8-12H2,(H2,20,21,22,25).
What are the key properties of 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one?
5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one has a molecular weight of 336.40 g/mol, XLogP of 2.35, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-benzylpiperidine-1-carbonyl)-1,3-dihydroimidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 136541158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).