3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine

C13H27NO — CID 62725662

IUPAC3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine
SMILESCOCCNCC(C)CC1CCCCC1
InChIInChI=1S/C13H27NO/c1-12(11-14-8-9-15-2)10-13-6-4-3-5-7-13/h12-14H,3-11H2,1-2H3
InChIKeyBAYIXMRZXJCHKW-UHFFFAOYSA-N
MW213.36 g/mol
LogP2.83
Rot. Bonds7

About 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine

3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine (PubChem CID 62725662) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine
PubChem CID62725662
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Name3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine
SMILESCOCCNCC(C)CC1CCCCC1
InChIInChI=1S/C13H27NO/c1-12(11-14-8-9-15-2)10-13-6-4-3-5-7-13/h12-14H,3-11H2,1-2H3
InChIKeyBAYIXMRZXJCHKW-UHFFFAOYSA-N
XLogP2.83
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine 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-(3-ethylcyclohexyl)-N-(2-methoxyethyl)-2-methylpropan-1-amine
CID 64666288
2-(cyclopentylmethyl)-N-(2-methoxyethyl)pentan-1-amine
CID 62718489
3-cyclopentyl-N-ethyl-2-methylpropan-1-amine
CID 62528074
2-cyclohexyl-N-(2-methoxyethyl)-3,3-dimethylbutan-1-amine
CID 83138862
2-cycloheptyl-N-(2-methoxyethyl)-3,3-dimethylbutan-1-amine
CID 83139451
3-cyclopentyl-N,2-dimethylpropan-1-amine
CID 62530877
1-cyclopentyl-3-(2-propan-2-yloxyethylamino)propan-2-ol
CID 103158287
2-cyclohexyl-N-(2-methoxyethyl)-2-methylsulfonylethanamine
CID 82933057
N-(3-cyclohexyl-2-methylpropyl)cyclobutanamine
CID 114899134
2-cyclobutyloxy-N-(2-methoxyethyl)propan-1-amine
CID 62582703
1-[cyclopentylmethyl(methyl)amino]-3-(2-methoxyethylamino)propan-2-ol
CID 113317593
2-methyl-3-(4-methylcyclohexyl)-N-propylpropan-1-amine
CID 64776338

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine?
The IUPAC name of 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine (CID 62725662) is 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine.
What is the SMILES notation for 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine?
The canonical SMILES for 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine is COCCNCC(C)CC1CCCCC1.
What is the InChIKey of 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine?
The InChIKey is BAYIXMRZXJCHKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-12(11-14-8-9-15-2)10-13-6-4-3-5-7-13/h12-14H,3-11H2,1-2H3.
What are the key properties of 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine?
3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine has a molecular weight of 213.36 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-(2-methoxyethyl)-2-methylpropan-1-amine is sourced from PubChem (CID 62725662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).