3-[(4-phenylcyclohexyl)amino]propan-1-ol

C15H23NO — CID 28714370

IUPAC3-[(4-phenylcyclohexyl)amino]propan-1-ol
SMILESOCCCNC1CCC(c2ccccc2)CC1
InChIInChI=1S/C15H23NO/c17-12-4-11-16-15-9-7-14(8-10-15)13-5-2-1-3-6-13/h1-3,5-6,14-17H,4,7-12H2
InChIKeyPFOCHGGYMIDRSI-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.68
Rot. Bonds5

About 3-[(4-phenylcyclohexyl)amino]propan-1-ol

3-[(4-phenylcyclohexyl)amino]propan-1-ol (PubChem CID 28714370) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 3-[(4-phenylcyclohexyl)amino]propan-1-ol.

Molecular Properties

Compound Name3-[(4-phenylcyclohexyl)amino]propan-1-ol
PubChem CID28714370
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name3-[(4-phenylcyclohexyl)amino]propan-1-ol
SMILESOCCCNC1CCC(c2ccccc2)CC1
InChIInChI=1S/C15H23NO/c17-12-4-11-16-15-9-7-14(8-10-15)13-5-2-1-3-6-13/h1-3,5-6,14-17H,4,7-12H2
InChIKeyPFOCHGGYMIDRSI-UHFFFAOYSA-N
XLogP2.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-[(4-phenylcyclohexyl)amino]propan-1-ol 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

4-[(4-phenylcyclohexyl)amino]butan-1-ol
CID 106841006
5-[(3-phenylcyclobutyl)amino]pentan-1-ol
CID 107303071
N-hex-5-ynyl-4-phenylcyclohexan-1-amine
CID 103903638
N-(5-methoxypentyl)-4-phenylcyclohexan-1-amine
CID 103779816
2-[(4-phenylcyclohexyl)amino]ethylurea
CID 83111311
N-[2-[(4-phenylcyclohexyl)amino]ethyl]cyclopropanecarboxamide
CID 115572811
N-(2-cyclopentyloxyethyl)-4-phenylcyclohexan-1-amine
CID 63824060
N,N-dimethyl-3-[(4-phenylcyclohexyl)amino]propanamide
CID 60925916
2-methyl-N-[2-[(4-phenylcyclohexyl)amino]ethyl]propanamide
CID 28650865
1-(2-hydroxyethyl)-3-(4-phenylcyclohexyl)urea
CID 110894206
3-(2,3-dihydro-1H-inden-2-ylamino)propan-1-ol
CID 3030975
N-(2,2-dimethylpropyl)-4-phenylcyclohexan-1-amine
CID 19381411

Frequently Asked Questions

What is the IUPAC name of 3-[(4-phenylcyclohexyl)amino]propan-1-ol?
The IUPAC name of 3-[(4-phenylcyclohexyl)amino]propan-1-ol (CID 28714370) is 3-[(4-phenylcyclohexyl)amino]propan-1-ol.
What is the SMILES notation for 3-[(4-phenylcyclohexyl)amino]propan-1-ol?
The canonical SMILES for 3-[(4-phenylcyclohexyl)amino]propan-1-ol is OCCCNC1CCC(c2ccccc2)CC1.
What is the InChIKey of 3-[(4-phenylcyclohexyl)amino]propan-1-ol?
The InChIKey is PFOCHGGYMIDRSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c17-12-4-11-16-15-9-7-14(8-10-15)13-5-2-1-3-6-13/h1-3,5-6,14-17H,4,7-12H2.
What are the key properties of 3-[(4-phenylcyclohexyl)amino]propan-1-ol?
3-[(4-phenylcyclohexyl)amino]propan-1-ol has a molecular weight of 233.36 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-phenylcyclohexyl)amino]propan-1-ol is sourced from PubChem (CID 28714370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).