1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide

C13H15ClN2O3 — CID 54943176

IUPAC1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1C(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C13H15ClN2O3/c14-8-4-5-9(11(17)7-8)13(19)16-6-2-1-3-10(16)12(15)18/h4-5,7,10,17H,1-3,6H2,(H2,15,18)
InChIKeyRJFRBTPFLHBRKE-UHFFFAOYSA-N
MW282.73 g/mol
LogP1.53
Rot. Bonds2

About 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide

1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide (PubChem CID 54943176) has the molecular formula C13H15ClN2O3 and a molecular weight of 282.73 g/mol. Its IUPAC name is 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide.

Molecular Properties

Compound Name1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide
PubChem CID54943176
Molecular FormulaC13H15ClN2O3
Molecular Weight282.73 g/mol
Exact Mass282.08
IUPAC Name1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide
SMILESNC(=O)C1CCCCN1C(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C13H15ClN2O3/c14-8-4-5-9(11(17)7-8)13(19)16-6-2-1-3-10(16)12(15)18/h4-5,7,10,17H,1-3,6H2,(H2,15,18)
InChIKeyRJFRBTPFLHBRKE-UHFFFAOYSA-N
XLogP1.53
TPSA83.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.73
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chloro-2-hydroxybenzoyl)azepane-2-carboxylic acid
CID 64559155
ethyl 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxylate
CID 43648357
(4-chloro-2-hydroxyphenyl)-(2-methylpiperidin-1-yl)methanone
CID 43176497
1-(2,5-dihydroxybenzoyl)piperidine-2-carboxamide
CID 107722668
2-[1-(4-chloro-2-hydroxybenzoyl)piperidin-2-yl]acetic acid
CID 61010246
(4-chloro-2-hydroxyphenyl)-(2-methylpyrrolidin-1-yl)methanone
CID 60975104
1-(2,4-dihydroxybenzoyl)piperidine-2-carbothioamide
CID 107722124
1-(4-chloro-2-fluorobenzoyl)-N'-hydroxypiperidine-2-carboximidamide
CID 77041508
1-(2-fluoro-5-sulfanylbenzoyl)piperidine-2-carboxamide
CID 107026087
1-(2-fluoro-5-methylbenzoyl)piperidine-2-carboxamide
CID 62508896
1-(3-hydroxynaphthalene-2-carbonyl)pyrrolidine-2-carboxamide
CID 11492936
(4-chloro-2-hydroxyphenyl)-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 79030485

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide?
The IUPAC name of 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide (CID 54943176) is 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide.
What is the SMILES notation for 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide?
The canonical SMILES for 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide is NC(=O)C1CCCCN1C(=O)c1ccc(Cl)cc1O.
What is the InChIKey of 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide?
The InChIKey is RJFRBTPFLHBRKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O3/c14-8-4-5-9(11(17)7-8)13(19)16-6-2-1-3-10(16)12(15)18/h4-5,7,10,17H,1-3,6H2,(H2,15,18).
What are the key properties of 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide?
1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide has a molecular weight of 282.73 g/mol, XLogP of 1.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-2-hydroxybenzoyl)piperidine-2-carboxamide is sourced from PubChem (CID 54943176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).