1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide

C13H16N2O4 — CID 103891600

IUPAC1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)c2cc(O)cc(O)c2)C1
InChIInChI=1S/C13H16N2O4/c14-12(18)8-2-1-3-15(7-8)13(19)9-4-10(16)6-11(17)5-9/h4-6,8,16-17H,1-3,7H2,(H2,14,18)
InChIKeyFHHRZDYMRNNIRO-UHFFFAOYSA-N
MW264.28 g/mol
LogP0.44
Rot. Bonds2

About 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide

1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide (PubChem CID 103891600) has the molecular formula C13H16N2O4 and a molecular weight of 264.28 g/mol. Its IUPAC name is 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide
PubChem CID103891600
Molecular FormulaC13H16N2O4
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC Name1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)c2cc(O)cc(O)c2)C1
InChIInChI=1S/C13H16N2O4/c14-12(18)8-2-1-3-15(7-8)13(19)9-4-10(16)6-11(17)5-9/h4-6,8,16-17H,1-3,7H2,(H2,14,18)
InChIKeyFHHRZDYMRNNIRO-UHFFFAOYSA-N
XLogP0.44
TPSA103.86 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 50.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-amino-3,5-dichlorobenzoyl)piperidine-3-carboxamide
CID 82832980
(3-chloropiperidin-1-yl)-(3,5-dihydroxyphenyl)methanone
CID 107705861
(3,5-dihydroxyphenyl)-pyrrolidin-1-ylmethanone
CID 103891305
1-(3-bromo-5-methylbenzoyl)piperidine-3-carboxamide
CID 104851796
(3S)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 68704612
cyclohexyl-[4-(3,5-dihydroxybenzoyl)-1,4-diazepan-1-yl]methanone
CID 108544690
1-(4-amino-3-fluorobenzoyl)piperidine-3-carboxamide
CID 62678681
[(3R)-3-aminopyrrolidin-1-yl]-(3,5-dihydroxyphenyl)methanone
CID 107705169
1-(5,6-dichloropyridine-3-carbonyl)piperidine-3-carboxamide
CID 43079586
1-(4-bromo-3-chlorobenzoyl)piperidine-3-carboxamide
CID 80961813
(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
CID 28826297
(3S)-1-(2,3-dimethylquinoxaline-6-carbonyl)piperidine-3-carboxamide
CID 94457790

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide?
The IUPAC name of 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide (CID 103891600) is 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide is NC(=O)C1CCCN(C(=O)c2cc(O)cc(O)c2)C1.
What is the InChIKey of 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide?
The InChIKey is FHHRZDYMRNNIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O4/c14-12(18)8-2-1-3-15(7-8)13(19)9-4-10(16)6-11(17)5-9/h4-6,8,16-17H,1-3,7H2,(H2,14,18).
What are the key properties of 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide?
1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide has a molecular weight of 264.28 g/mol, XLogP of 0.44, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide is sourced from PubChem (CID 103891600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).