3-amino-3-phenylcyclobutan-1-ol;hydrochloride

C10H14ClNO — CID 126838126

IUPAC3-amino-3-phenylcyclobutan-1-ol;hydrochloride
SMILESCl.NC1(c2ccccc2)CC(O)C1
InChIInChI=1S/C10H13NO.ClH/c11-10(6-9(12)7-10)8-4-2-1-3-5-8;/h1-5,9,12H,6-7,11H2;1H
InChIKeyRXOVUERNTXNPJG-UHFFFAOYSA-N
MW199.68 g/mol
LogP1.42
Rot. Bonds1

About 3-amino-3-phenylcyclobutan-1-ol;hydrochloride

3-amino-3-phenylcyclobutan-1-ol;hydrochloride (PubChem CID 126838126) has the molecular formula C10H14ClNO and a molecular weight of 199.68 g/mol. Its IUPAC name is 3-amino-3-phenylcyclobutan-1-ol;hydrochloride.

Molecular Properties

Compound Name3-amino-3-phenylcyclobutan-1-ol;hydrochloride
PubChem CID126838126
Molecular FormulaC10H14ClNO
Molecular Weight199.68 g/mol
Exact Mass199.08
IUPAC Name3-amino-3-phenylcyclobutan-1-ol;hydrochloride
SMILESCl.NC1(c2ccccc2)CC(O)C1
InChIInChI=1S/C10H13NO.ClH/c11-10(6-9(12)7-10)8-4-2-1-3-5-8;/h1-5,9,12H,6-7,11H2;1H
InChIKeyRXOVUERNTXNPJG-UHFFFAOYSA-N
XLogP1.42
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-amino-3-phenylcyclobutan-1-ol;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-phenylcyclobutan-1-ol;hydrochloride?
The IUPAC name of 3-amino-3-phenylcyclobutan-1-ol;hydrochloride (CID 126838126) is 3-amino-3-phenylcyclobutan-1-ol;hydrochloride.
What is the SMILES notation for 3-amino-3-phenylcyclobutan-1-ol;hydrochloride?
The canonical SMILES for 3-amino-3-phenylcyclobutan-1-ol;hydrochloride is Cl.NC1(c2ccccc2)CC(O)C1.
What is the InChIKey of 3-amino-3-phenylcyclobutan-1-ol;hydrochloride?
The InChIKey is RXOVUERNTXNPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO.ClH/c11-10(6-9(12)7-10)8-4-2-1-3-5-8;/h1-5,9,12H,6-7,11H2;1H.
What are the key properties of 3-amino-3-phenylcyclobutan-1-ol;hydrochloride?
3-amino-3-phenylcyclobutan-1-ol;hydrochloride has a molecular weight of 199.68 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-phenylcyclobutan-1-ol;hydrochloride is sourced from PubChem (CID 126838126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).