N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide

C17H25NO2 — CID 110287930

IUPACN-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide
SMILESCOc1ccc(CCN(C)C(=O)C2CCCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-18(17(19)15-6-4-3-5-7-15)13-12-14-8-10-16(20-2)11-9-14/h8-11,15H,3-7,12-13H2,1-2H3
InChIKeyRGJRCXPZZOUBQN-UHFFFAOYSA-N
MW275.39 g/mol
LogP3.28
Rot. Bonds5

About N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide

N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide (PubChem CID 110287930) has the molecular formula C17H25NO2 and a molecular weight of 275.39 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide
PubChem CID110287930
Molecular FormulaC17H25NO2
Molecular Weight275.39 g/mol
Exact Mass275.19
IUPAC NameN-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide
SMILESCOc1ccc(CCN(C)C(=O)C2CCCCC2)cc1
InChIInChI=1S/C17H25NO2/c1-18(17(19)15-6-4-3-5-7-15)13-12-14-8-10-16(20-2)11-9-14/h8-11,15H,3-7,12-13H2,1-2H3
InChIKeyRGJRCXPZZOUBQN-UHFFFAOYSA-N
XLogP3.28
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.39
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclohexyl-1-[2-(4-methoxyphenyl)ethyl]-1-methylurea
CID 110287969
1-benzoyl-N-[2-(4-methoxyphenyl)ethyl]-N-methylpiperidine-4-carboxamide
CID 110307099
3-cyclopropyl-1-[2-(4-methoxyphenyl)ethyl]-1-methylurea
CID 110307110
1-[2-(4-methoxyphenyl)ethyl]-1-methylurea
CID 115168599
cyclohexanol;ethane;2-(4-methoxyphenyl)-N,N-dimethylethanamine
CID 143482708
1-cyclopentyl-4-(4-methoxyphenyl)butan-1-one
CID 113390085
ethyl N-[2-(4-methoxyphenyl)ethyl]-N-methylcarbamate
CID 110287988
3,5-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]-N-methylbenzamide
CID 110287948
N'-[2-(4-methoxyphenyl)acetyl]cyclohexanecarbohydrazide
CID 965816
N-[(4-methoxyphenyl)methyl]-N,1-dimethylpiperidine-3-carboxamide
CID 132649734
2-N-[2-(4-methoxyphenyl)ethyl]-2-N-methylcyclohexane-1,2-diamine
CID 102639912
1-[3-(4-methoxyphenyl)propanoyl]-N,N-dimethylpiperidine-4-carboxamide
CID 110350832

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide?
The IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide (CID 110287930) is N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide is COc1ccc(CCN(C)C(=O)C2CCCCC2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide?
The InChIKey is RGJRCXPZZOUBQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO2/c1-18(17(19)15-6-4-3-5-7-15)13-12-14-8-10-16(20-2)11-9-14/h8-11,15H,3-7,12-13H2,1-2H3.
What are the key properties of N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide?
N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide has a molecular weight of 275.39 g/mol, XLogP of 3.28, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)ethyl]-N-methylcyclohexanecarboxamide is sourced from PubChem (CID 110287930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).