N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide

C16H24N2O — CID 63121399

IUPACN,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
SMILESCc1ccc(CN(C)C(=O)C2(C)CCNCC2)cc1
InChIInChI=1S/C16H24N2O/c1-13-4-6-14(7-5-13)12-18(3)15(19)16(2)8-10-17-11-9-16/h4-7,17H,8-12H2,1-3H3
InChIKeyPTVLVIMGGOFYAG-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.34
Rot. Bonds3

About N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide

N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide (PubChem CID 63121399) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
PubChem CID63121399
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
SMILESCc1ccc(CN(C)C(=O)C2(C)CCNCC2)cc1
InChIInChI=1S/C16H24N2O/c1-13-4-6-14(7-5-13)12-18(3)15(19)16(2)8-10-17-11-9-16/h4-7,17H,8-12H2,1-3H3
InChIKeyPTVLVIMGGOFYAG-UHFFFAOYSA-N
XLogP2.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-fluorophenyl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 63138507
N-[(3,5-dichlorophenyl)methyl]-N,4-dimethylpiperidine-4-carboxamide
CID 63121984
4-[methyl-[(4-methylphenyl)methyl]carbamoyl]bicyclo[2.2.2]octane-1-carboxylic acid
CID 166815654
1-[methyl-[(4-methylphenyl)methyl]carbamoyl]cyclobutane-1-carboxylic acid
CID 62095554
N-[(4-bromophenyl)methyl]-N,1-dimethylcyclohexane-1-carboxamide
CID 104985630
N-[(4-fluorophenyl)methyl]-N-methyl-4-propylpiperidine-4-carboxamide
CID 63128063
N-[(4-ethylphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide;hydrochloride
CID 119943770
N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide
CID 119681307
N-[(3-hydroxyphenyl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 63143386
N-[(3-bromophenyl)methyl]-N,3-dimethylpyrrolidine-3-carboxamide
CID 63143655
N,3-dimethyl-N-[(4-propan-2-ylphenyl)methyl]piperidine-3-carboxamide
CID 63131135
4-methyl-N-(4-methylphenyl)piperidine-4-carboxamide
CID 63121506

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide (CID 63121399) is N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide is Cc1ccc(CN(C)C(=O)C2(C)CCNCC2)cc1.
What is the InChIKey of N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide?
The InChIKey is PTVLVIMGGOFYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13-4-6-14(7-5-13)12-18(3)15(19)16(2)8-10-17-11-9-16/h4-7,17H,8-12H2,1-3H3.
What are the key properties of N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide?
N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide has a molecular weight of 260.38 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 63121399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).