N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide

C13H16ClN3O2 — CID 43701566

IUPACN-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide
SMILESNC(=O)c1ccc(Cl)c(NC(=O)C2CCCCN2)c1
InChIInChI=1S/C13H16ClN3O2/c14-9-5-4-8(12(15)18)7-11(9)17-13(19)10-3-1-2-6-16-10/h4-5,7,10,16H,1-3,6H2,(H2,15,18)(H,17,19)
InChIKeyRZUYZOHRLDGHGJ-UHFFFAOYSA-N
MW281.74 g/mol
LogP1.52
Rot. Bonds3

About N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide

N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide (PubChem CID 43701566) has the molecular formula C13H16ClN3O2 and a molecular weight of 281.74 g/mol. Its IUPAC name is N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide
PubChem CID43701566
Molecular FormulaC13H16ClN3O2
Molecular Weight281.74 g/mol
Exact Mass281.09
IUPAC NameN-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide
SMILESNC(=O)c1ccc(Cl)c(NC(=O)C2CCCCN2)c1
InChIInChI=1S/C13H16ClN3O2/c14-9-5-4-8(12(15)18)7-11(9)17-13(19)10-3-1-2-6-16-10/h4-5,7,10,16H,1-3,6H2,(H2,15,18)(H,17,19)
InChIKeyRZUYZOHRLDGHGJ-UHFFFAOYSA-N
XLogP1.52
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.74
LogP ≤ 51.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-carbamoyl-2-chlorophenyl)azepane-2-carboxamide
CID 64563989
(2S)-N-(2-chloro-5-methylphenyl)piperidine-2-carboxamide
CID 103808460
5-[[(2R)-piperidine-2-carbonyl]amino]benzene-1,3-dicarboxamide
CID 104913671
(2R)-N-(2-chloro-5-nitrophenyl)piperidine-2-carboxamide
CID 104913032
(2R)-N-(2-chloro-5-methylsulfonylphenyl)piperidine-2-carboxamide
CID 104912877
(2S)-N-(2-chloro-5-methylphenyl)pyrrolidine-2-carboxamide
CID 103794561
N-(5-acetamido-2-chlorophenyl)pyrrolidine-2-carboxamide
CID 119280739
(2S)-N-(4-carbamoyl-3-chlorophenyl)piperidine-2-carboxamide
CID 103808831
N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride
CID 42943662
N-(3-carbamoylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119270285
N-(2,3-dichlorophenyl)azepane-2-carboxamide
CID 64563193
(2R)-N-(3-chloro-2-fluorophenyl)piperidine-2-carboxamide
CID 28969312

Frequently Asked Questions

What is the IUPAC name of N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide?
The IUPAC name of N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide (CID 43701566) is N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide?
The canonical SMILES for N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide is NC(=O)c1ccc(Cl)c(NC(=O)C2CCCCN2)c1.
What is the InChIKey of N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide?
The InChIKey is RZUYZOHRLDGHGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN3O2/c14-9-5-4-8(12(15)18)7-11(9)17-13(19)10-3-1-2-6-16-10/h4-5,7,10,16H,1-3,6H2,(H2,15,18)(H,17,19).
What are the key properties of N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide?
N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide has a molecular weight of 281.74 g/mol, XLogP of 1.52, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-carbamoyl-2-chlorophenyl)piperidine-2-carboxamide is sourced from PubChem (CID 43701566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).