2-(4-aminophenyl)cyclopropan-1-ol

C9H11NO — CID 115011767

IUPAC2-(4-aminophenyl)cyclopropan-1-ol
SMILESNc1ccc(C2CC2O)cc1
InChIInChI=1S/C9H11NO/c10-7-3-1-6(2-4-7)8-5-9(8)11/h1-4,8-9,11H,5,10H2
InChIKeyMETZLCDUQAGWEB-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.12
Rot. Bonds1

About 2-(4-aminophenyl)cyclopropan-1-ol

2-(4-aminophenyl)cyclopropan-1-ol (PubChem CID 115011767) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 2-(4-aminophenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name2-(4-aminophenyl)cyclopropan-1-ol
PubChem CID115011767
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name2-(4-aminophenyl)cyclopropan-1-ol
SMILESNc1ccc(C2CC2O)cc1
InChIInChI=1S/C9H11NO/c10-7-3-1-6(2-4-7)8-5-9(8)11/h1-4,8-9,11H,5,10H2
InChIKeyMETZLCDUQAGWEB-UHFFFAOYSA-N
XLogP1.12
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-(4-aminophenyl)cyclopropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(1S,2S)-2-(trifluoromethyl)cyclopropyl]aniline
CID 71669152
2-(4-tert-butylphenyl)cyclopropan-1-ol
CID 142590960
trans-methyl (1S,2S)-2-(4-aminophenyl)cyclopropane-1-carboxylate
CID 124585525
3-(4-aminophenyl)-1-(2-hydroxyethyl)pyrrolidin-2-ol
CID 167133514
3-(4-aminophenoxy)cyclobutan-1-ol
CID 170347103
4-[(3S,5R)-3,5-dimethylcyclohexyl]aniline
CID 125449153
4-(aziridin-2-yl)aniline
CID 87528388
tert-butyl N-[(1R,2S)-2-(4-aminophenyl)cyclopropyl]carbamate
CID 86673140
4-[2-(fluoromethyl)cyclopentyl]aniline
CID 115019500
(3S,4R)-4-(4-aminophenyl)-1-methylpyrrolidine-3-carboxamide
CID 99986873
(3S,4R)-4-(4-aminophenyl)-1-methylpyrrolidine-3-carboxylic acid
CID 99986899
benzene-1,4-diamine;nickel
CID 87271840

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)cyclopropan-1-ol?
The IUPAC name of 2-(4-aminophenyl)cyclopropan-1-ol (CID 115011767) is 2-(4-aminophenyl)cyclopropan-1-ol.
What is the SMILES notation for 2-(4-aminophenyl)cyclopropan-1-ol?
The canonical SMILES for 2-(4-aminophenyl)cyclopropan-1-ol is Nc1ccc(C2CC2O)cc1.
What is the InChIKey of 2-(4-aminophenyl)cyclopropan-1-ol?
The InChIKey is METZLCDUQAGWEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c10-7-3-1-6(2-4-7)8-5-9(8)11/h1-4,8-9,11H,5,10H2.
What are the key properties of 2-(4-aminophenyl)cyclopropan-1-ol?
2-(4-aminophenyl)cyclopropan-1-ol has a molecular weight of 149.19 g/mol, XLogP of 1.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)cyclopropan-1-ol is sourced from PubChem (CID 115011767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).