N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide

C15H22N2O — CID 62002271

IUPACN-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide
SMILESCc1cc(C)cc(N(C)C(=O)C2CCNCC2)c1
InChIInChI=1S/C15H22N2O/c1-11-8-12(2)10-14(9-11)17(3)15(18)13-4-6-16-7-5-13/h8-10,13,16H,4-7H2,1-3H3
InChIKeyZBCHICVCLFHWON-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.27
Rot. Bonds2

About N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide

N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide (PubChem CID 62002271) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide
PubChem CID62002271
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide
SMILESCc1cc(C)cc(N(C)C(=O)C2CCNCC2)c1
InChIInChI=1S/C15H22N2O/c1-11-8-12(2)10-14(9-11)17(3)15(18)13-4-6-16-7-5-13/h8-10,13,16H,4-7H2,1-3H3
InChIKeyZBCHICVCLFHWON-UHFFFAOYSA-N
XLogP2.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide (CID 62002271) is N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide is Cc1cc(C)cc(N(C)C(=O)C2CCNCC2)c1.
What is the InChIKey of N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide?
The InChIKey is ZBCHICVCLFHWON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-11-8-12(2)10-14(9-11)17(3)15(18)13-4-6-16-7-5-13/h8-10,13,16H,4-7H2,1-3H3.
What are the key properties of N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide?
N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide has a molecular weight of 246.35 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylphenyl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 62002271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).