oxolan-2-amine

C4H9NO — CID 11412342

IUPACoxolan-2-amine
SMILESNC1CCCO1
InChIInChI=1S/C4H9NO/c5-4-2-1-3-6-4/h4H,1-3,5H2
InChIKeyKQOATKAFTRNONV-UHFFFAOYSA-N
MW87.12 g/mol
LogP0.08
Rot. Bonds

About oxolan-2-amine

oxolan-2-amine (PubChem CID 11412342) has the molecular formula C4H9NO and a molecular weight of 87.12 g/mol. Its IUPAC name is oxolan-2-amine.

Molecular Properties

Compound Nameoxolan-2-amine
PubChem CID11412342
Molecular FormulaC4H9NO
Molecular Weight87.12 g/mol
Exact Mass87.07
IUPAC Nameoxolan-2-amine
SMILESNC1CCCO1
InChIInChI=1S/C4H9NO/c5-4-2-1-3-6-4/h4H,1-3,5H2
InChIKeyKQOATKAFTRNONV-UHFFFAOYSA-N
XLogP0.08
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.12
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze oxolan-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 oxolan-2-amine?
The IUPAC name of oxolan-2-amine (CID 11412342) is oxolan-2-amine.
What is the SMILES notation for oxolan-2-amine?
The canonical SMILES for oxolan-2-amine is NC1CCCO1.
What is the InChIKey of oxolan-2-amine?
The InChIKey is KQOATKAFTRNONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO/c5-4-2-1-3-6-4/h4H,1-3,5H2.
What are the key properties of oxolan-2-amine?
oxolan-2-amine has a molecular weight of 87.12 g/mol, XLogP of 0.08, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-amine is sourced from PubChem (CID 11412342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).