[1-(4-aminophenyl)cyclopropyl]methanol

C10H13NO — CID 82275279

IUPAC[1-(4-aminophenyl)cyclopropyl]methanol
SMILESNc1ccc(C2(CO)CC2)cc1
InChIInChI=1S/C10H13NO/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4,12H,5-7,11H2
InChIKeyGKJDRRCZPHCTJA-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.29
Rot. Bonds2

About [1-(4-aminophenyl)cyclopropyl]methanol

[1-(4-aminophenyl)cyclopropyl]methanol (PubChem CID 82275279) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is [1-(4-aminophenyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[1-(4-aminophenyl)cyclopropyl]methanol
PubChem CID82275279
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name[1-(4-aminophenyl)cyclopropyl]methanol
SMILESNc1ccc(C2(CO)CC2)cc1
InChIInChI=1S/C10H13NO/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4,12H,5-7,11H2
InChIKeyGKJDRRCZPHCTJA-UHFFFAOYSA-N
XLogP1.29
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 ≤ 51.29
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 [1-(4-aminophenyl)cyclopropyl]methanol?
The IUPAC name of [1-(4-aminophenyl)cyclopropyl]methanol (CID 82275279) is [1-(4-aminophenyl)cyclopropyl]methanol.
What is the SMILES notation for [1-(4-aminophenyl)cyclopropyl]methanol?
The canonical SMILES for [1-(4-aminophenyl)cyclopropyl]methanol is Nc1ccc(C2(CO)CC2)cc1.
What is the InChIKey of [1-(4-aminophenyl)cyclopropyl]methanol?
The InChIKey is GKJDRRCZPHCTJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c11-9-3-1-8(2-4-9)10(7-12)5-6-10/h1-4,12H,5-7,11H2.
What are the key properties of [1-(4-aminophenyl)cyclopropyl]methanol?
[1-(4-aminophenyl)cyclopropyl]methanol has a molecular weight of 163.22 g/mol, XLogP of 1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-aminophenyl)cyclopropyl]methanol is sourced from PubChem (CID 82275279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).