(1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone

C24H27N5O2 — CID 134795960

IUPAC(1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1)N1CCCC(C(=O)N2CCC(c3nc4ccncc4[nH]3)CC2)C1
InChIInChI=1S/C24H27N5O2/c30-23(18-5-2-1-3-6-18)29-12-4-7-19(16-29)24(31)28-13-9-17(10-14-28)22-26-20-8-11-25-15-21(20)27-22/h1-3,5-6,8,11,15,17,19H,4,7,9-10,12-14,16H2,(H,26,27)
InChIKeyRBGDFADHKBOESV-UHFFFAOYSA-N
MW417.51 g/mol
LogP3.22
Rot. Bonds3

About (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone

(1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone (PubChem CID 134795960) has the molecular formula C24H27N5O2 and a molecular weight of 417.51 g/mol. Its IUPAC name is (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone
PubChem CID134795960
Molecular FormulaC24H27N5O2
Molecular Weight417.51 g/mol
Exact Mass417.22
IUPAC Name(1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone
SMILESO=C(c1ccccc1)N1CCCC(C(=O)N2CCC(c3nc4ccncc4[nH]3)CC2)C1
InChIInChI=1S/C24H27N5O2/c30-23(18-5-2-1-3-6-18)29-12-4-7-19(16-29)24(31)28-13-9-17(10-14-28)22-26-20-8-11-25-15-21(20)27-22/h1-3,5-6,8,11,15,17,19H,4,7,9-10,12-14,16H2,(H,26,27)
InChIKeyRBGDFADHKBOESV-UHFFFAOYSA-N
XLogP3.22
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.51
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone with MolForge

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Related Compounds

cyclopentyl-[3-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]piperidin-1-yl]methanone
CID 134797363
[1-(2-chlorobenzoyl)piperidin-3-yl]-[3-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidin-1-yl]methanone
CID 134799871
cyclopentyl-[3-[3-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]piperidin-1-yl]methanone
CID 134798256
[(3S)-3-(1H-benzimidazol-2-yl)pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 51137015
[3-(1H-benzimidazol-2-yl)piperidin-1-yl]-pyridin-4-ylmethanone
CID 46509091
N-(4-chlorophenyl)-3-[3-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]piperidine-1-carboxamide
CID 134796934
2-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidine-1-carbonyl]-N-phenylpyrrolidine-1-carboxamide
CID 134799475
[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-(1-pyrimidin-2-ylpiperidin-3-yl)methanone
CID 55576245
[4-(1H-imidazo[4,5-b]pyridin-2-yl)piperidin-1-yl]-[1-[4-(trifluoromethyl)benzoyl]piperidin-3-yl]methanone
CID 134800138
methyl 4-[3-(3H-imidazo[4,5-c]pyridin-2-yl)pyrrolidine-1-carbonyl]piperidine-1-carboxylate
CID 134796420
[(3S)-3-(1H-benzimidazol-2-yl)piperidin-1-yl]-(4-phenylphenyl)methanone
CID 58494516
[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone
CID 134799195

Frequently Asked Questions

What is the IUPAC name of (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone?
The IUPAC name of (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone (CID 134795960) is (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone is O=C(c1ccccc1)N1CCCC(C(=O)N2CCC(c3nc4ccncc4[nH]3)CC2)C1.
What is the InChIKey of (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone?
The InChIKey is RBGDFADHKBOESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N5O2/c30-23(18-5-2-1-3-6-18)29-12-4-7-19(16-29)24(31)28-13-9-17(10-14-28)22-26-20-8-11-25-15-21(20)27-22/h1-3,5-6,8,11,15,17,19H,4,7,9-10,12-14,16H2,(H,26,27).
What are the key properties of (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone?
(1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone has a molecular weight of 417.51 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzoylpiperidin-3-yl)-[4-(3H-imidazo[4,5-c]pyridin-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 134795960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).