3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide

C15H20N4O3 — CID 43022872

IUPAC3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide
SMILESCNC(=O)c1ccccc1NC(=O)C1CCCN(C(N)=O)C1
InChIInChI=1S/C15H20N4O3/c1-17-14(21)11-6-2-3-7-12(11)18-13(20)10-5-4-8-19(9-10)15(16)22/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,16,22)(H,17,21)(H,18,20)
InChIKeyOGPQBLPORAOLAL-UHFFFAOYSA-N
MW304.35 g/mol
LogP0.78
Rot. Bonds3

About 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide

3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide (PubChem CID 43022872) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide
PubChem CID43022872
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide
SMILESCNC(=O)c1ccccc1NC(=O)C1CCCN(C(N)=O)C1
InChIInChI=1S/C15H20N4O3/c1-17-14(21)11-6-2-3-7-12(11)18-13(20)10-5-4-8-19(9-10)15(16)22/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,16,22)(H,17,21)(H,18,20)
InChIKeyOGPQBLPORAOLAL-UHFFFAOYSA-N
XLogP0.78
TPSA104.53 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-[[(2-chlorobenzoyl)amino]carbamoyl]piperidine-1-carboxamide
CID 8870376
1-acetyl-N-[2-(2-aminoethylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 120604476
N-[2-(methylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 18071955
3-N-[2-(2-aminoethylcarbamoyl)phenyl]-1-N-(2-methylpropyl)piperidine-1,3-dicarboxamide
CID 120603479
N-[2-methyl-3-(methylcarbamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 46461736
(3S)-1-methylsulfonyl-N-[2-(piperidine-1-carbonyl)phenyl]piperidine-3-carboxamide
CID 33170416
(3S)-3-N-pyridin-2-ylpiperidine-1,3-dicarboxamide
CID 51927409
3-[(1-carbamoylpiperidine-3-carbonyl)amino]thiophene-2-carboxylic acid
CID 43171793
1-(4-fluorobenzoyl)-N-[2-(methylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 51218219
N-[2-[(4-methylphenyl)methylcarbamoyl]phenyl]-1-(2-phenylacetyl)piperidine-3-carboxamide
CID 55607859
N-[2-(propan-2-ylcarbamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55672694
N-[2-(azepane-1-carbonyl)phenyl]-1-methylpiperidine-4-carboxamide
CID 99970642

Frequently Asked Questions

What is the IUPAC name of 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide?
The IUPAC name of 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide (CID 43022872) is 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide.
What is the SMILES notation for 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide?
The canonical SMILES for 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide is CNC(=O)c1ccccc1NC(=O)C1CCCN(C(N)=O)C1.
What is the InChIKey of 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide?
The InChIKey is OGPQBLPORAOLAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-17-14(21)11-6-2-3-7-12(11)18-13(20)10-5-4-8-19(9-10)15(16)22/h2-3,6-7,10H,4-5,8-9H2,1H3,(H2,16,22)(H,17,21)(H,18,20).
What are the key properties of 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide?
3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide has a molecular weight of 304.35 g/mol, XLogP of 0.78, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-[2-(methylcarbamoyl)phenyl]piperidine-1,3-dicarboxamide is sourced from PubChem (CID 43022872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).