1-(1-amino-2-phenylethyl)cyclopentan-1-ol

C13H19NO — CID 19702313

IUPAC1-(1-amino-2-phenylethyl)cyclopentan-1-ol
SMILESNC(Cc1ccccc1)C1(O)CCCC1
InChIInChI=1S/C13H19NO/c14-12(13(15)8-4-5-9-13)10-11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10,14H2
InChIKeyWIXQOWFUZDGWLU-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.86
Rot. Bonds3

About 1-(1-amino-2-phenylethyl)cyclopentan-1-ol

1-(1-amino-2-phenylethyl)cyclopentan-1-ol (PubChem CID 19702313) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(1-amino-2-phenylethyl)cyclopentan-1-ol.

Molecular Properties

Compound Name1-(1-amino-2-phenylethyl)cyclopentan-1-ol
PubChem CID19702313
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(1-amino-2-phenylethyl)cyclopentan-1-ol
SMILESNC(Cc1ccccc1)C1(O)CCCC1
InChIInChI=1S/C13H19NO/c14-12(13(15)8-4-5-9-13)10-11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10,14H2
InChIKeyWIXQOWFUZDGWLU-UHFFFAOYSA-N
XLogP1.86
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(1-amino-2-phenylethyl)cyclopentan-1-ol?
The IUPAC name of 1-(1-amino-2-phenylethyl)cyclopentan-1-ol (CID 19702313) is 1-(1-amino-2-phenylethyl)cyclopentan-1-ol.
What is the SMILES notation for 1-(1-amino-2-phenylethyl)cyclopentan-1-ol?
The canonical SMILES for 1-(1-amino-2-phenylethyl)cyclopentan-1-ol is NC(Cc1ccccc1)C1(O)CCCC1.
What is the InChIKey of 1-(1-amino-2-phenylethyl)cyclopentan-1-ol?
The InChIKey is WIXQOWFUZDGWLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c14-12(13(15)8-4-5-9-13)10-11-6-2-1-3-7-11/h1-3,6-7,12,15H,4-5,8-10,14H2.
What are the key properties of 1-(1-amino-2-phenylethyl)cyclopentan-1-ol?
1-(1-amino-2-phenylethyl)cyclopentan-1-ol has a molecular weight of 205.30 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-amino-2-phenylethyl)cyclopentan-1-ol is sourced from PubChem (CID 19702313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).