N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide

C15H22N2O — CID 155036949

IUPACN-(2,3,6-trimethylphenyl)piperidine-2-carboxamide
SMILESCc1ccc(C)c(NC(=O)C2CCCCN2)c1C
InChIInChI=1S/C15H22N2O/c1-10-7-8-11(2)14(12(10)3)17-15(18)13-6-4-5-9-16-13/h7-8,13,16H,4-6,9H2,1-3H3,(H,17,18)
InChIKeyHQKSLLHEWVUGNK-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.69
Rot. Bonds2

About N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide

N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide (PubChem CID 155036949) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3,6-trimethylphenyl)piperidine-2-carboxamide
PubChem CID155036949
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(2,3,6-trimethylphenyl)piperidine-2-carboxamide
SMILESCc1ccc(C)c(NC(=O)C2CCCCN2)c1C
InChIInChI=1S/C15H22N2O/c1-10-7-8-11(2)14(12(10)3)17-15(18)13-6-4-5-9-16-13/h7-8,13,16H,4-6,9H2,1-3H3,(H,17,18)
InChIKeyHQKSLLHEWVUGNK-UHFFFAOYSA-N
XLogP2.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,6-dimethylphenyl)azepane-2-carboxamide
CID 64562214
N-(2-ethyl-6-methylphenyl)azepane-2-carboxamide
CID 64562791
N-(2-methyl-6-propan-2-ylphenyl)piperidine-2-carboxamide
CID 10730082
N-(2,6-diethylphenyl)piperidine-2-carboxamide
CID 24706345
(2R)-N-(3-hydroxy-4-methylphenyl)piperidine-2-carboxamide
CID 107701571
(2R)-N-(2-chloro-6-methylphenyl)pyrrolidine-2-carboxamide
CID 104901241
N-(2-methyl-5-methylsulfonylphenyl)piperidine-2-carboxamide
CID 43703422
(2R)-N-(4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119670939
(2S)-N-(3-hydroxy-2,4-dimethylphenyl)pyrrolidine-2-carboxamide
CID 61179515
N-(3-hydroxy-2,4-dimethylphenyl)pyrrolidine-2-carboxamide
CID 43710389
(2S)-N-(2,3-dimethylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119261902
N-(3-chloro-4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119262099

Frequently Asked Questions

What is the IUPAC name of N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide?
The IUPAC name of N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide (CID 155036949) is N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide.
What is the SMILES notation for N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide?
The canonical SMILES for N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide is Cc1ccc(C)c(NC(=O)C2CCCCN2)c1C.
What is the InChIKey of N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide?
The InChIKey is HQKSLLHEWVUGNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-10-7-8-11(2)14(12(10)3)17-15(18)13-6-4-5-9-16-13/h7-8,13,16H,4-6,9H2,1-3H3,(H,17,18).
What are the key properties of N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide?
N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.69, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,6-trimethylphenyl)piperidine-2-carboxamide is sourced from PubChem (CID 155036949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).