4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide

C17H26N2O2 — CID 60936865

IUPAC4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)C2CCC(N)CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-3-21-16-10-4-13(5-11-16)12-19(2)17(20)14-6-8-15(18)9-7-14/h4-5,10-11,14-15H,3,6-9,12,18H2,1-2H3
InChIKeyZCOBQQYEEKRSOM-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.56
Rot. Bonds5

About 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide

4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide (PubChem CID 60936865) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide
PubChem CID60936865
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide
SMILESCCOc1ccc(CN(C)C(=O)C2CCC(N)CC2)cc1
InChIInChI=1S/C17H26N2O2/c1-3-21-16-10-4-13(5-11-16)12-19(2)17(20)14-6-8-15(18)9-7-14/h4-5,10-11,14-15H,3,6-9,12,18H2,1-2H3
InChIKeyZCOBQQYEEKRSOM-UHFFFAOYSA-N
XLogP2.56
TPSA55.56 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 ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide;hydrochloride
CID 119681006
4-amino-N-methyl-N-[(4-methylphenyl)methyl]cyclohexane-1-carboxamide
CID 60847411
(3R)-N-[(4-ethoxyphenyl)methyl]-N-methylpiperidine-3-carboxamide
CID 81124371
N-[(4-ethylphenyl)methyl]-N-methylcyclopropanecarboxamide
CID 60630877
(2S)-N-[(4-ethoxyphenyl)methyl]-N-methyl-5-oxopyrrolidine-2-carboxamide
CID 95286846
N-[(4-ethoxyphenyl)methyl]-2-ethyl-N-methylbutanamide
CID 78780749
4-amino-N-[(3-chlorophenyl)methyl]-N-methylcyclohexane-1-carboxamide
CID 54868902
2-[4-[[(4,4-difluorocyclohexanecarbonyl)-methylamino]methyl]phenoxy]acetic acid
CID 120538094
2-(4-amino-3,3-dimethylpiperidin-1-yl)-N-[(4-ethoxyphenyl)methyl]-N-methylacetamide
CID 120775332
4-[methyl-[[4-(trifluoromethoxy)phenyl]methyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 120672619
N-[(4-ethoxyphenyl)methyl]-N-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide
CID 119266748
N-[[4-(aminomethyl)phenyl]methyl]-N-methylcyclopentanecarboxamide
CID 54939453

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide?
The IUPAC name of 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide (CID 60936865) is 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide?
The canonical SMILES for 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide is CCOc1ccc(CN(C)C(=O)C2CCC(N)CC2)cc1.
What is the InChIKey of 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide?
The InChIKey is ZCOBQQYEEKRSOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-3-21-16-10-4-13(5-11-16)12-19(2)17(20)14-6-8-15(18)9-7-14/h4-5,10-11,14-15H,3,6-9,12,18H2,1-2H3.
What are the key properties of 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide?
4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[(4-ethoxyphenyl)methyl]-N-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 60936865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).