N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide

C16H24N2O2 — CID 106739545

IUPACN-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide
SMILESCOc1ccccc1CN(C)C(=O)C1CCNC(C)C1
InChIInChI=1S/C16H24N2O2/c1-12-10-13(8-9-17-12)16(19)18(2)11-14-6-4-5-7-15(14)20-3/h4-7,12-13,17H,8-11H2,1-3H3
InChIKeyYBCCHFDTAMZPEX-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.04
Rot. Bonds4

About N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide

N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide (PubChem CID 106739545) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide
PubChem CID106739545
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide
SMILESCOc1ccccc1CN(C)C(=O)C1CCNC(C)C1
InChIInChI=1S/C16H24N2O2/c1-12-10-13(8-9-17-12)16(19)18(2)11-14-6-4-5-7-15(14)20-3/h4-7,12-13,17H,8-11H2,1-3H3
InChIKeyYBCCHFDTAMZPEX-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4S)-N-cyclopropyl-N-[(2-methoxyphenyl)methyl]-2-methylpiperidine-4-carboxamide
CID 120621349
(2S,4S)-N-cyclopropyl-N-[(2-methoxyphenyl)methyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120621348
N-[(2-methoxyphenyl)methyl]-N,3-dimethylpyrrolidine-2-carboxamide
CID 102778901
(2S,4S)-N-[(2-methoxyphenyl)methyl]-2-methyl-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide
CID 120617754
(2S,4S)-N-[(4-methoxy-3-methylphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide
CID 120629959
(2S,4S)-N-[(2,3-dichlorophenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide;hydrochloride
CID 120617441
(3S)-N-[(2-methoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 81128624
(2S,4S)-N-[(2-methoxyphenyl)methyl]-2-methylpiperidine-4-carboxamide
CID 120616660
N-[(2-methoxyphenyl)methyl]-N,6-dimethylpiperidine-2-carboxamide
CID 61417523
(2S,4S)-N-(1-benzothiophen-3-ylmethyl)-N,2-dimethylpiperidine-4-carboxamide
CID 120620566
4-(aminomethyl)-N-[(2-methoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide
CID 79511106
N-[(2-methoxyphenyl)methyl]-N-methylpiperazine-2-carboxamide
CID 55178802

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide (CID 106739545) is N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide is COc1ccccc1CN(C)C(=O)C1CCNC(C)C1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide?
The InChIKey is YBCCHFDTAMZPEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-10-13(8-9-17-12)16(19)18(2)11-14-6-4-5-7-15(14)20-3/h4-7,12-13,17H,8-11H2,1-3H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide?
N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-N,2-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 106739545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).