N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide

C14H19N3O2 — CID 110471858

IUPACN-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
SMILESCc1ccc(C(N)=O)cc1NC(=O)C1CCNCC1
InChIInChI=1S/C14H19N3O2/c1-9-2-3-11(13(15)18)8-12(9)17-14(19)10-4-6-16-7-5-10/h2-3,8,10,16H,4-7H2,1H3,(H2,15,18)(H,17,19)
InChIKeyNPQBUGOZSYOWMP-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.03
Rot. Bonds3

About N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide

N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide (PubChem CID 110471858) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
PubChem CID110471858
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC NameN-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
SMILESCc1ccc(C(N)=O)cc1NC(=O)C1CCNCC1
InChIInChI=1S/C14H19N3O2/c1-9-2-3-11(13(15)18)8-12(9)17-14(19)10-4-6-16-7-5-10/h2-3,8,10,16H,4-7H2,1H3,(H2,15,18)(H,17,19)
InChIKeyNPQBUGOZSYOWMP-UHFFFAOYSA-N
XLogP1.03
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-carbamoyl-2-methylphenyl)piperidine-4-carboxamide
CID 43706641
N-(2,5-dimethylphenyl)piperidine-4-carboxamide
CID 18073176
N-(4-carbamoyl-2-methylphenyl)pyrrolidine-3-carboxamide
CID 63007219
N-(2-methyl-5-methylsulfonylphenyl)piperidine-4-carboxamide
CID 43703421
N-[5-(2,2-dimethylpropanoylamino)-2-methylphenyl]piperidine-4-carboxamide
CID 119321946
N-[3-(2,2-dimethylpropanoylamino)-4-methylphenyl]piperidine-4-carboxamide
CID 119321965
N-(3-carbamoylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119270283
5-(piperidine-4-carbonylamino)benzene-1,3-dicarboxamide
CID 61276320
N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119261898
(3S)-N-[5-[(3R,5R)-3,5-dimethylpiperidine-1-carbonyl]-2-methylphenyl]pyrrolidine-3-carboxamide
CID 124889380
N-(3-methyl-4-pyridinyl)piperidine-4-carboxamide
CID 63670702
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623

Frequently Asked Questions

What is the IUPAC name of N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide?
The IUPAC name of N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide (CID 110471858) is N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide?
The canonical SMILES for N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide is Cc1ccc(C(N)=O)cc1NC(=O)C1CCNCC1.
What is the InChIKey of N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide?
The InChIKey is NPQBUGOZSYOWMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-9-2-3-11(13(15)18)8-12(9)17-14(19)10-4-6-16-7-5-10/h2-3,8,10,16H,4-7H2,1H3,(H2,15,18)(H,17,19).
What are the key properties of N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide?
N-(5-carbamoyl-2-methylphenyl)piperidine-4-carboxamide has a molecular weight of 261.32 g/mol, XLogP of 1.03, 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-methylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 110471858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).