1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine

C16H25NO2 — CID 82715212

IUPAC1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine
SMILESCOCCONC(c1ccccc1)C1CCCCC1
InChIInChI=1S/C16H25NO2/c1-18-12-13-19-17-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2,4-5,8-9,15-17H,3,6-7,10-13H2,1H3
InChIKeyKLJREGPTAZJLNM-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.48
Rot. Bonds7

About 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine

1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine (PubChem CID 82715212) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine
PubChem CID82715212
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine
SMILESCOCCONC(c1ccccc1)C1CCCCC1
InChIInChI=1S/C16H25NO2/c1-18-12-13-19-17-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2,4-5,8-9,15-17H,3,6-7,10-13H2,1H3
InChIKeyKLJREGPTAZJLNM-UHFFFAOYSA-N
XLogP3.48
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine 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

N-[cyclohexyl(phenyl)methyl]-2-methoxy-2-methylpropan-1-amine
CID 104759566
2-[[(S)-cyclopentyl(phenyl)methyl]amino]acetonitrile
CID 95619544
2-[[cyclopentyl(phenyl)methyl]amino]acetonitrile
CID 56785981
N-[(R)-cyclopentyl(phenyl)methyl]-4-methoxybenzamide
CID 978301
2-[[cyclopropyl(phenyl)methyl]amino]oxyacetamide
CID 112672575
N-[cyclopentyl(phenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 2964253
2-[4-[2-[[cyclopentyl(phenyl)methyl]amino]-2-oxoethyl]piperazin-1-yl]-N-(2-methoxyethyl)acetamide
CID 60502756
N-[cyclohexyl(phenyl)methyl]-2,5-dimethylpyrrol-1-amine
CID 79107738
N-[cyclohexyl(phenyl)methyl]-3-ethenoxypropan-1-amine
CID 43099675
ethyl 2-[[cyclohexyl(phenyl)methyl]amino]acetate
CID 60811477
N-[cyclobutyl(phenyl)methyl]ethanamine
CID 43489136
N-[cyclohexyl(phenyl)methyl]-3-(4-methoxyphenyl)propan-1-amine;hydrochloride
CID 67118786

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine?
The IUPAC name of 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine (CID 82715212) is 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine.
What is the SMILES notation for 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine?
The canonical SMILES for 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine is COCCONC(c1ccccc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine?
The InChIKey is KLJREGPTAZJLNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c1-18-12-13-19-17-16(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2,4-5,8-9,15-17H,3,6-7,10-13H2,1H3.
What are the key properties of 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine?
1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine has a molecular weight of 263.38 g/mol, XLogP of 3.48, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(2-methoxyethoxy)-1-phenylmethanamine is sourced from PubChem (CID 82715212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).