5-[(3-phenylcyclobutyl)amino]pentan-1-ol

C15H23NO — CID 107303071

IUPAC5-[(3-phenylcyclobutyl)amino]pentan-1-ol
SMILESOCCCCCNC1CC(c2ccccc2)C1
InChIInChI=1S/C15H23NO/c17-10-6-2-5-9-16-15-11-14(12-15)13-7-3-1-4-8-13/h1,3-4,7-8,14-17H,2,5-6,9-12H2
InChIKeyZAXGWAYDTDKWCX-UHFFFAOYSA-N
MW233.36 g/mol
LogP2.68
Rot. Bonds7

About 5-[(3-phenylcyclobutyl)amino]pentan-1-ol

5-[(3-phenylcyclobutyl)amino]pentan-1-ol (PubChem CID 107303071) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is 5-[(3-phenylcyclobutyl)amino]pentan-1-ol.

Molecular Properties

Compound Name5-[(3-phenylcyclobutyl)amino]pentan-1-ol
PubChem CID107303071
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name5-[(3-phenylcyclobutyl)amino]pentan-1-ol
SMILESOCCCCCNC1CC(c2ccccc2)C1
InChIInChI=1S/C15H23NO/c17-10-6-2-5-9-16-15-11-14(12-15)13-7-3-1-4-8-13/h1,3-4,7-8,14-17H,2,5-6,9-12H2
InChIKeyZAXGWAYDTDKWCX-UHFFFAOYSA-N
XLogP2.68
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
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'}

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Related Compounds

4-[(4-phenylcyclohexyl)amino]butan-1-ol
CID 106841006
4-[[3-(3-bromophenyl)cyclobutyl]amino]butan-1-ol
CID 106840971
N-(5-methylsulfanylpentyl)-3-phenylcyclobutan-1-amine
CID 104926345
6-[[3-(2-bromophenyl)cyclobutyl]amino]hexan-1-ol
CID 107849622
3-[(4-phenylcyclohexyl)amino]propan-1-ol
CID 28714370
3-[[3-(4-bromophenyl)cyclobutyl]amino]propan-1-ol
CID 43634672
4-[[3-(2-methylphenyl)cyclobutyl]amino]butan-1-ol
CID 106841126
3-phenyl-N-(4,4,4-trifluorobutyl)cyclobutan-1-amine
CID 115516339
N-[2-[(3-phenylcyclobutyl)amino]ethyl]acetamide
CID 43632255
N-[3-(cyclopropylmethoxy)propyl]-3-phenylcyclobutan-1-amine
CID 43632261
3-[(3-phenylcyclobutyl)amino]propanenitrile
CID 43632270
3-(4-chlorophenyl)-N-(3-phenylpropyl)cyclobutan-1-amine
CID 43634161

Frequently Asked Questions

What is the IUPAC name of 5-[(3-phenylcyclobutyl)amino]pentan-1-ol?
The IUPAC name of 5-[(3-phenylcyclobutyl)amino]pentan-1-ol (CID 107303071) is 5-[(3-phenylcyclobutyl)amino]pentan-1-ol.
What is the SMILES notation for 5-[(3-phenylcyclobutyl)amino]pentan-1-ol?
The canonical SMILES for 5-[(3-phenylcyclobutyl)amino]pentan-1-ol is OCCCCCNC1CC(c2ccccc2)C1.
What is the InChIKey of 5-[(3-phenylcyclobutyl)amino]pentan-1-ol?
The InChIKey is ZAXGWAYDTDKWCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c17-10-6-2-5-9-16-15-11-14(12-15)13-7-3-1-4-8-13/h1,3-4,7-8,14-17H,2,5-6,9-12H2.
What are the key properties of 5-[(3-phenylcyclobutyl)amino]pentan-1-ol?
5-[(3-phenylcyclobutyl)amino]pentan-1-ol has a molecular weight of 233.36 g/mol, XLogP of 2.68, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3-phenylcyclobutyl)amino]pentan-1-ol is sourced from PubChem (CID 107303071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).