N-phenyloxolan-2-amine

C10H13NO — CID 123811944

IUPACN-phenyloxolan-2-amine
SMILESc1ccc(NC2CCCO2)cc1
InChIInChI=1S/C10H13NO/c1-2-5-9(6-3-1)11-10-7-4-8-12-10/h1-3,5-6,10-11H,4,7-8H2
InChIKeyFCZZTLDXEGSBPM-UHFFFAOYSA-N
MW163.22 g/mol
LogP2.23
Rot. Bonds2

About N-phenyloxolan-2-amine

N-phenyloxolan-2-amine (PubChem CID 123811944) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is N-phenyloxolan-2-amine.

Molecular Properties

Compound NameN-phenyloxolan-2-amine
PubChem CID123811944
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC NameN-phenyloxolan-2-amine
SMILESc1ccc(NC2CCCO2)cc1
InChIInChI=1S/C10H13NO/c1-2-5-9(6-3-1)11-10-7-4-8-12-10/h1-3,5-6,10-11H,4,7-8H2
InChIKeyFCZZTLDXEGSBPM-UHFFFAOYSA-N
XLogP2.23
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-phenyloxolan-2-amine 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 N-phenyloxolan-2-amine?
The IUPAC name of N-phenyloxolan-2-amine (CID 123811944) is N-phenyloxolan-2-amine.
What is the SMILES notation for N-phenyloxolan-2-amine?
The canonical SMILES for N-phenyloxolan-2-amine is c1ccc(NC2CCCO2)cc1.
What is the InChIKey of N-phenyloxolan-2-amine?
The InChIKey is FCZZTLDXEGSBPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-2-5-9(6-3-1)11-10-7-4-8-12-10/h1-3,5-6,10-11H,4,7-8H2.
What are the key properties of N-phenyloxolan-2-amine?
N-phenyloxolan-2-amine has a molecular weight of 163.22 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyloxolan-2-amine is sourced from PubChem (CID 123811944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).