1-(2-phenylethylamino)cyclopentan-1-ol

C13H19NO — CID 67750997

IUPAC1-(2-phenylethylamino)cyclopentan-1-ol
SMILESOC1(NCCc2ccccc2)CCCC1
InChIInChI=1S/C13H19NO/c15-13(9-4-5-10-13)14-11-8-12-6-2-1-3-7-12/h1-3,6-7,14-15H,4-5,8-11H2
InChIKeyWAPAVZVBFDTWHB-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.08
Rot. Bonds4

About 1-(2-phenylethylamino)cyclopentan-1-ol

1-(2-phenylethylamino)cyclopentan-1-ol (PubChem CID 67750997) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(2-phenylethylamino)cyclopentan-1-ol.

Molecular Properties

Compound Name1-(2-phenylethylamino)cyclopentan-1-ol
PubChem CID67750997
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(2-phenylethylamino)cyclopentan-1-ol
SMILESOC1(NCCc2ccccc2)CCCC1
InChIInChI=1S/C13H19NO/c15-13(9-4-5-10-13)14-11-8-12-6-2-1-3-7-12/h1-3,6-7,14-15H,4-5,8-11H2
InChIKeyWAPAVZVBFDTWHB-UHFFFAOYSA-N
XLogP2.08
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(3-phenylpropylamino)cyclohexan-1-ol
CID 141002398
1-[(2-phenylethylamino)methyl]cyclopentan-1-ol
CID 65105220
N-(2-phenylethyl)-1-prop-2-enylcyclooctan-1-amine
CID 101017768
ethyl 1-(2-phenylethylamino)cyclopentane-1-carboxylate
CID 152760490
[1-[(2-phenylethylamino)methyl]cyclohexyl]methanol
CID 81411898
4,4-dimethyl-1-[(2-phenylethylamino)methyl]cyclohexan-1-ol
CID 65117177
1-(2-phenylethyl)cyclopent-3-en-1-ol
CID 139771599
1-[(benzylamino)methyl]cycloheptan-1-ol
CID 60710694
1-(1-hydroxy-3-phenylpropyl)cyclopentan-1-ol
CID 103448481
N'-[(1-hydroxycyclopentyl)methyl]-N-(3-phenylpropyl)oxamide
CID 111332854
1-(chloromethyl)-3-methyl-N-(2-phenylethyl)cyclohexan-1-amine
CID 65030361
1-[2-(3-methylphenyl)ethylamino]cyclopentane-1-carboxylic acid
CID 114999787

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylethylamino)cyclopentan-1-ol?
The IUPAC name of 1-(2-phenylethylamino)cyclopentan-1-ol (CID 67750997) is 1-(2-phenylethylamino)cyclopentan-1-ol.
What is the SMILES notation for 1-(2-phenylethylamino)cyclopentan-1-ol?
The canonical SMILES for 1-(2-phenylethylamino)cyclopentan-1-ol is OC1(NCCc2ccccc2)CCCC1.
What is the InChIKey of 1-(2-phenylethylamino)cyclopentan-1-ol?
The InChIKey is WAPAVZVBFDTWHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c15-13(9-4-5-10-13)14-11-8-12-6-2-1-3-7-12/h1-3,6-7,14-15H,4-5,8-11H2.
What are the key properties of 1-(2-phenylethylamino)cyclopentan-1-ol?
1-(2-phenylethylamino)cyclopentan-1-ol has a molecular weight of 205.30 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylethylamino)cyclopentan-1-ol is sourced from PubChem (CID 67750997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).