3-cyclohexyl-1-phenylpropan-1-amine

C15H23N — CID 43110402

IUPAC3-cyclohexyl-1-phenylpropan-1-amine
SMILESNC(CCC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H23N/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h2,5-6,9-10,13,15H,1,3-4,7-8,11-12,16H2
InChIKeyQTFOODCFMBORLR-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.05
Rot. Bonds4

About 3-cyclohexyl-1-phenylpropan-1-amine

3-cyclohexyl-1-phenylpropan-1-amine (PubChem CID 43110402) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3-cyclohexyl-1-phenylpropan-1-amine.

Molecular Properties

Compound Name3-cyclohexyl-1-phenylpropan-1-amine
PubChem CID43110402
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3-cyclohexyl-1-phenylpropan-1-amine
SMILESNC(CCC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H23N/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h2,5-6,9-10,13,15H,1,3-4,7-8,11-12,16H2
InChIKeyQTFOODCFMBORLR-UHFFFAOYSA-N
XLogP4.05
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-cyclopentyl-1-phenylbutan-1-amine
CID 64504653
2-cycloheptyl-1-phenylethanamine
CID 21261900
3-(3-ethylcyclohexyl)-1-phenylpropan-1-amine
CID 64505370
3-cyclopentyl-1-(4-propan-2-ylphenyl)propan-1-amine
CID 43625227
1-(4-bromophenyl)-3-cyclopentylpropan-1-amine
CID 43184859
1-(4-tert-butylphenyl)-3-cyclopentylpropan-1-amine
CID 43110325
3-cyclopentyl-1-naphthalen-2-ylpropan-1-amine
CID 115851068
3-(2-ethylcyclohexyl)-1-phenylpropan-1-amine
CID 64502784
3-cyclopentyl-1-(4-propylphenyl)propan-1-amine
CID 43106075
1-cyclohexyl-5-phenylpentan-3-amine
CID 115793645
2-cyclobutyl-1-phenylethanamine;hydrochloride
CID 131675142
N-(3-amino-3-phenylpropyl)-2-cycloheptylacetamide
CID 114458464

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-phenylpropan-1-amine?
The IUPAC name of 3-cyclohexyl-1-phenylpropan-1-amine (CID 43110402) is 3-cyclohexyl-1-phenylpropan-1-amine.
What is the SMILES notation for 3-cyclohexyl-1-phenylpropan-1-amine?
The canonical SMILES for 3-cyclohexyl-1-phenylpropan-1-amine is NC(CCC1CCCCC1)c1ccccc1.
What is the InChIKey of 3-cyclohexyl-1-phenylpropan-1-amine?
The InChIKey is QTFOODCFMBORLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h2,5-6,9-10,13,15H,1,3-4,7-8,11-12,16H2.
What are the key properties of 3-cyclohexyl-1-phenylpropan-1-amine?
3-cyclohexyl-1-phenylpropan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 4.05, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-phenylpropan-1-amine is sourced from PubChem (CID 43110402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).