5-methyloxolan-3-amine

C5H11NO — CID 22011941

IUPAC5-methyloxolan-3-amine
SMILESCC1CC(N)CO1
InChIInChI=1S/C5H11NO/c1-4-2-5(6)3-7-4/h4-5H,2-3,6H2,1H3
InChIKeyHLAUKISKFSLYFI-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.12
Rot. Bonds

About 5-methyloxolan-3-amine

5-methyloxolan-3-amine (PubChem CID 22011941) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 5-methyloxolan-3-amine.

Molecular Properties

Compound Name5-methyloxolan-3-amine
PubChem CID22011941
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name5-methyloxolan-3-amine
SMILESCC1CC(N)CO1
InChIInChI=1S/C5H11NO/c1-4-2-5(6)3-7-4/h4-5H,2-3,6H2,1H3
InChIKeyHLAUKISKFSLYFI-UHFFFAOYSA-N
XLogP0.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyloxolan-3-amine?
The IUPAC name of 5-methyloxolan-3-amine (CID 22011941) is 5-methyloxolan-3-amine.
What is the SMILES notation for 5-methyloxolan-3-amine?
The canonical SMILES for 5-methyloxolan-3-amine is CC1CC(N)CO1.
What is the InChIKey of 5-methyloxolan-3-amine?
The InChIKey is HLAUKISKFSLYFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-4-2-5(6)3-7-4/h4-5H,2-3,6H2,1H3.
What are the key properties of 5-methyloxolan-3-amine?
5-methyloxolan-3-amine has a molecular weight of 101.15 g/mol, XLogP of 0.12, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyloxolan-3-amine is sourced from PubChem (CID 22011941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).