[2-(2-aminophenyl)cyclopropyl]methanol

C10H13NO — CID 115012846

IUPAC[2-(2-aminophenyl)cyclopropyl]methanol
SMILESNc1ccccc1C1CC1CO
InChIInChI=1S/C10H13NO/c11-10-4-2-1-3-8(10)9-5-7(9)6-12/h1-4,7,9,12H,5-6,11H2
InChIKeyPBOLCXLFQINUFL-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.36
Rot. Bonds2

About [2-(2-aminophenyl)cyclopropyl]methanol

[2-(2-aminophenyl)cyclopropyl]methanol (PubChem CID 115012846) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is [2-(2-aminophenyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[2-(2-aminophenyl)cyclopropyl]methanol
PubChem CID115012846
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name[2-(2-aminophenyl)cyclopropyl]methanol
SMILESNc1ccccc1C1CC1CO
InChIInChI=1S/C10H13NO/c11-10-4-2-1-3-8(10)9-5-7(9)6-12/h1-4,7,9,12H,5-6,11H2
InChIKeyPBOLCXLFQINUFL-UHFFFAOYSA-N
XLogP1.36
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-(2-aminophenyl)cyclopropyl]methanol?
The IUPAC name of [2-(2-aminophenyl)cyclopropyl]methanol (CID 115012846) is [2-(2-aminophenyl)cyclopropyl]methanol.
What is the SMILES notation for [2-(2-aminophenyl)cyclopropyl]methanol?
The canonical SMILES for [2-(2-aminophenyl)cyclopropyl]methanol is Nc1ccccc1C1CC1CO.
What is the InChIKey of [2-(2-aminophenyl)cyclopropyl]methanol?
The InChIKey is PBOLCXLFQINUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c11-10-4-2-1-3-8(10)9-5-7(9)6-12/h1-4,7,9,12H,5-6,11H2.
What are the key properties of [2-(2-aminophenyl)cyclopropyl]methanol?
[2-(2-aminophenyl)cyclopropyl]methanol has a molecular weight of 163.22 g/mol, XLogP of 1.36, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-aminophenyl)cyclopropyl]methanol is sourced from PubChem (CID 115012846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).