1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide

C25H25N3O3 — CID 51132718

IUPAC1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccn1)C1CCN(C(=O)c2cc(Cc3ccccc3)ccc2O)CC1
InChIInChI=1S/C25H25N3O3/c29-22-10-9-19(16-18-6-2-1-3-7-18)17-21(22)25(31)28-14-11-20(12-15-28)24(30)27-23-8-4-5-13-26-23/h1-10,13,17,20,29H,11-12,14-16H2,(H,26,27,30)
InChIKeyBEPBHXNZAPYJSC-UHFFFAOYSA-N
MW415.49 g/mol
LogP3.87
Rot. Bonds5

About 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide

1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide (PubChem CID 51132718) has the molecular formula C25H25N3O3 and a molecular weight of 415.49 g/mol. Its IUPAC name is 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide
PubChem CID51132718
Molecular FormulaC25H25N3O3
Molecular Weight415.49 g/mol
Exact Mass415.19
IUPAC Name1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccn1)C1CCN(C(=O)c2cc(Cc3ccccc3)ccc2O)CC1
InChIInChI=1S/C25H25N3O3/c29-22-10-9-19(16-18-6-2-1-3-7-18)17-21(22)25(31)28-14-11-20(12-15-28)24(30)27-23-8-4-5-13-26-23/h1-10,13,17,20,29H,11-12,14-16H2,(H,26,27,30)
InChIKeyBEPBHXNZAPYJSC-UHFFFAOYSA-N
XLogP3.87
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.49
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(furan-2-carbonyl)-N-pyridin-2-ylpiperidine-4-carboxamide
CID 17081700
(3-anilinopyrrolidin-1-yl)-(5-benzyl-2-hydroxyphenyl)methanone
CID 56504216
1-(2-ethoxypyridine-3-carbonyl)-N-pyridin-2-ylpiperidine-4-carboxamide
CID 55808630
(5-benzyl-2-hydroxyphenyl)-[(3R)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]piperidin-1-yl]methanone
CID 95350597
1-(2-oxo-1H-quinoline-4-carbonyl)-N-pyridin-2-ylpiperidine-4-carboxamide
CID 71893089
1-(1-methylindole-3-carbonyl)-N-pyridin-2-ylpiperidine-4-carboxamide
CID 51123650
N-(4-benzylphenyl)-1-(2-cyanobenzoyl)piperidine-4-carboxamide
CID 70644256
1-(2-phenylsulfanylacetyl)-N-pyridin-2-ylpiperidine-4-carboxamide
CID 55808341
N-pyridin-2-yl-1-[2-(pyridin-3-ylmethylsulfanyl)acetyl]piperidine-4-carboxamide
CID 55808540
1-(6-chloro-2-methylquinoline-3-carbonyl)-N-pyridin-2-ylpiperidine-4-carboxamide
CID 55808313
1-(7-hydroxy-2,2-dimethyl-3H-1-benzofuran-6-carbonyl)-N-pyridin-2-ylpiperidine-4-carboxamide
CID 51135163
1-[3-(4-fluorophenyl)propanoyl]-N-pyridin-2-ylpyrrolidine-3-carboxamide
CID 110246626

Frequently Asked Questions

What is the IUPAC name of 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide?
The IUPAC name of 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide (CID 51132718) is 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide is O=C(Nc1ccccn1)C1CCN(C(=O)c2cc(Cc3ccccc3)ccc2O)CC1.
What is the InChIKey of 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide?
The InChIKey is BEPBHXNZAPYJSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N3O3/c29-22-10-9-19(16-18-6-2-1-3-7-18)17-21(22)25(31)28-14-11-20(12-15-28)24(30)27-23-8-4-5-13-26-23/h1-10,13,17,20,29H,11-12,14-16H2,(H,26,27,30).
What are the key properties of 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide?
1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide has a molecular weight of 415.49 g/mol, XLogP of 3.87, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-benzyl-2-hydroxybenzoyl)-N-pyridin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 51132718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).