N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide

C17H26N2O2 — CID 119681307

IUPACN-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide
SMILESCCc1ccc(CN(C)C(=O)C2(OC)CCNCC2)cc1
InChIInChI=1S/C17H26N2O2/c1-4-14-5-7-15(8-6-14)13-19(2)16(20)17(21-3)9-11-18-12-10-17/h5-8,18H,4,9-13H2,1-3H3
InChIKeyXLHOZBLCVAUWJK-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.98
Rot. Bonds5

About N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide

N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide (PubChem CID 119681307) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide
PubChem CID119681307
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide
SMILESCCc1ccc(CN(C)C(=O)C2(OC)CCNCC2)cc1
InChIInChI=1S/C17H26N2O2/c1-4-14-5-7-15(8-6-14)13-19(2)16(20)17(21-3)9-11-18-12-10-17/h5-8,18H,4,9-13H2,1-3H3
InChIKeyXLHOZBLCVAUWJK-UHFFFAOYSA-N
XLogP1.98
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-hydroxy-3-methoxyphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide;hydrochloride
CID 119705016
4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide
CID 119681705
N-[(5-bromothiophen-2-yl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide
CID 119688975
N-butyl-4-methoxy-N-methylpiperidine-4-carboxamide
CID 119672323
N-[2-(dimethylamino)-2-(4-ethylphenyl)ethyl]-4-methoxypiperidine-4-carboxamide
CID 119831132
N-[(4-fluorophenyl)methyl]-N-methyl-4-propylpiperidine-4-carboxamide
CID 63128063
N-[(4-ethylphenyl)methyl]-N,3-dimethylpiperidine-3-carboxamide;hydrochloride
CID 119943770
4-methoxy-N,N-dimethylpiperidine-4-carboxamide
CID 84660627
N,4-dimethyl-N-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 63121399
4-methoxy-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidine-4-carboxamide;dihydrochloride
CID 119859315
4-methoxy-N-methyl-N-(2-methylpropyl)piperidine-4-carboxamide;hydrochloride
CID 119708518
4-methoxy-N-methyl-N-(4-methylphenyl)piperidine-4-carboxamide
CID 119706067

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide?
The IUPAC name of N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide (CID 119681307) is N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide is CCc1ccc(CN(C)C(=O)C2(OC)CCNCC2)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide?
The InChIKey is XLHOZBLCVAUWJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-4-14-5-7-15(8-6-14)13-19(2)16(20)17(21-3)9-11-18-12-10-17/h5-8,18H,4,9-13H2,1-3H3.
What are the key properties of N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide?
N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-4-methoxy-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 119681307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).