3-cyclohexyloxy-3-phenylpropan-1-amine

C15H23NO — CID 115002872

IUPAC3-cyclohexyloxy-3-phenylpropan-1-amine
SMILESNCCC(OC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H23NO/c16-12-11-15(13-7-3-1-4-8-13)17-14-9-5-2-6-10-14/h1,3-4,7-8,14-15H,2,5-6,9-12,16H2
InChIKeyBUIPLEOKSPGOIK-UHFFFAOYSA-N
MW233.36 g/mol
LogP3.43
Rot. Bonds5

About 3-cyclohexyloxy-3-phenylpropan-1-amine

3-cyclohexyloxy-3-phenylpropan-1-amine (PubChem CID 115002872) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 3-cyclohexyloxy-3-phenylpropan-1-amine.

Molecular Properties

Compound Name3-cyclohexyloxy-3-phenylpropan-1-amine
PubChem CID115002872
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name3-cyclohexyloxy-3-phenylpropan-1-amine
SMILESNCCC(OC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H23NO/c16-12-11-15(13-7-3-1-4-8-13)17-14-9-5-2-6-10-14/h1,3-4,7-8,14-15H,2,5-6,9-12,16H2
InChIKeyBUIPLEOKSPGOIK-UHFFFAOYSA-N
XLogP3.43
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyloxy-3-phenylpropan-1-amine
CID 115001323
2-cyclohexyloxy-2-(2-fluorophenyl)ethanamine
CID 55018547
(2-benzylsulfanyl-1-cyclohexyloxyethyl)benzene
CID 135035914
O-(3-amino-1-phenylpropyl)hydroxylamine
CID 58171394
1-[3-cyclohexyloxy-3-(4-phenylphenyl)propyl]piperidine;hydrochloride
CID 23039558
1-cyclohexyloxy-1-phenylpropan-2-amine
CID 55017556
(3S)-3-phenoxy-3-phenylpropan-1-amine
CID 11736303
2-cyclohexyloxy-2-phenylacetonitrile
CID 101349721
[2-iodo-1-(4-methylphenyl)ethoxy]cycloheptane
CID 114773753
[2-iodo-1-(3-methoxycyclohexyl)oxyethyl]benzene
CID 114774282
2-cyclohexyloxy-2-phenylacetic acid
CID 43424351
[cyclopentyloxy(methoxy)methyl]benzene
CID 54296518

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyloxy-3-phenylpropan-1-amine?
The IUPAC name of 3-cyclohexyloxy-3-phenylpropan-1-amine (CID 115002872) is 3-cyclohexyloxy-3-phenylpropan-1-amine.
What is the SMILES notation for 3-cyclohexyloxy-3-phenylpropan-1-amine?
The canonical SMILES for 3-cyclohexyloxy-3-phenylpropan-1-amine is NCCC(OC1CCCCC1)c1ccccc1.
What is the InChIKey of 3-cyclohexyloxy-3-phenylpropan-1-amine?
The InChIKey is BUIPLEOKSPGOIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c16-12-11-15(13-7-3-1-4-8-13)17-14-9-5-2-6-10-14/h1,3-4,7-8,14-15H,2,5-6,9-12,16H2.
What are the key properties of 3-cyclohexyloxy-3-phenylpropan-1-amine?
3-cyclohexyloxy-3-phenylpropan-1-amine has a molecular weight of 233.36 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyloxy-3-phenylpropan-1-amine is sourced from PubChem (CID 115002872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).