2-cyclohexyl-N-methyl-3-phenylpropan-1-amine

C16H25N — CID 82931379

IUPAC2-cyclohexyl-N-methyl-3-phenylpropan-1-amine
SMILESCNCC(Cc1ccccc1)C1CCCCC1
InChIInChI=1S/C16H25N/c1-17-13-16(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2,4-5,8-9,15-17H,3,6-7,10-13H2,1H3
InChIKeyUMYIIJXKCLJYFG-UHFFFAOYSA-N
MW231.38 g/mol
LogP3.64
Rot. Bonds5

About 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine

2-cyclohexyl-N-methyl-3-phenylpropan-1-amine (PubChem CID 82931379) has the molecular formula C16H25N and a molecular weight of 231.38 g/mol. Its IUPAC name is 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine.

Molecular Properties

Compound Name2-cyclohexyl-N-methyl-3-phenylpropan-1-amine
PubChem CID82931379
Molecular FormulaC16H25N
Molecular Weight231.38 g/mol
Exact Mass231.20
IUPAC Name2-cyclohexyl-N-methyl-3-phenylpropan-1-amine
SMILESCNCC(Cc1ccccc1)C1CCCCC1
InChIInChI=1S/C16H25N/c1-17-13-16(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2,4-5,8-9,15-17H,3,6-7,10-13H2,1H3
InChIKeyUMYIIJXKCLJYFG-UHFFFAOYSA-N
XLogP3.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.38
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-cyclohexyl-N-methyl-3-phenylpropan-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

N-(2-cycloheptyl-3-phenylpropyl)cyclopropanamine
CID 82932346
2-cyclopentyl-N-methyl-3-(4-propan-2-ylphenyl)propan-1-amine
CID 112569760
2-cyclohexyl-3-phenylpropan-1-ol
CID 82936977
2-cyclopentyl-N-methyl-3-thiophen-3-ylpropan-1-amine
CID 112569789
N-(2-cyclopropyl-3-phenylpropyl)cyclopropanamine
CID 104819239
2-cyclohexylpropylbenzene
CID 15846297
2-cycloheptyl-N-methyl-2-phenylethanamine
CID 82934094
3-cyclohexyl-4-phenyl-N-(1-phenylethyl)butan-1-amine
CID 58599580
N-[2-cyclohexyl-3-(4-methylphenyl)propyl]cyclopropanamine
CID 82934027
3-(1-benzothiophen-3-yl)-2-cyclopentyl-N-methylpropan-1-amine
CID 112569750
(1R)-1-cyclopentyl-2-phenylethanol
CID 39238299
1-cycloheptyl-N-methyl-3-phenylpropan-2-amine
CID 114458143

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine?
The IUPAC name of 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine (CID 82931379) is 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine.
What is the SMILES notation for 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine?
The canonical SMILES for 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine is CNCC(Cc1ccccc1)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine?
The InChIKey is UMYIIJXKCLJYFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N/c1-17-13-16(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2,4-5,8-9,15-17H,3,6-7,10-13H2,1H3.
What are the key properties of 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine?
2-cyclohexyl-N-methyl-3-phenylpropan-1-amine has a molecular weight of 231.38 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-methyl-3-phenylpropan-1-amine is sourced from PubChem (CID 82931379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).