3-(cyclobutylmethylamino)oxolan-2-one

C9H15NO2 — CID 130652699

IUPAC3-(cyclobutylmethylamino)oxolan-2-one
SMILESO=C1OCCC1NCC1CCC1
InChIInChI=1S/C9H15NO2/c11-9-8(4-5-12-9)10-6-7-2-1-3-7/h7-8,10H,1-6H2
InChIKeyAMITXLPKUDHYOG-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.69
Rot. Bonds3

About 3-(cyclobutylmethylamino)oxolan-2-one

3-(cyclobutylmethylamino)oxolan-2-one (PubChem CID 130652699) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 3-(cyclobutylmethylamino)oxolan-2-one.

Molecular Properties

Compound Name3-(cyclobutylmethylamino)oxolan-2-one
PubChem CID130652699
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name3-(cyclobutylmethylamino)oxolan-2-one
SMILESO=C1OCCC1NCC1CCC1
InChIInChI=1S/C9H15NO2/c11-9-8(4-5-12-9)10-6-7-2-1-3-7/h7-8,10H,1-6H2
InChIKeyAMITXLPKUDHYOG-UHFFFAOYSA-N
XLogP0.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-isovaleryl-L-homoserine lactone
CID 71627311
2-cyclobutyl-N-[(3S)-2-oxooxolan-3-yl]acetamide
CID 171351895
3-(Cyclohexylamino)oxolan-2-one
CID 43824131
3-[(3-Fluorocyclopentyl)amino]oxolan-2-one
CID 130649635
3-[(3,3-Difluorocyclobutyl)methylamino]oxolan-2-one
CID 130719923
3-Methyl-N-(tetrahydro-2-oxo-3-furanyl)butanamide (Racemic)
CID 23020664
(3R)-3-(2-methylpropylamino)oxolan-2-one
CID 28420700
(3S)-3-(2-methylpropylamino)oxolan-2-one
CID 28420702
(3S)-3-(butylamino)oxolan-2-one
CID 28421622
(3S)-3-(pentylamino)oxolan-2-one
CID 28563677
3-(2-Methylpropylamino)oxolan-2-one
CID 43823903
3-(Butylamino)oxolan-2-one
CID 43824118

Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethylamino)oxolan-2-one?
The IUPAC name of 3-(cyclobutylmethylamino)oxolan-2-one (CID 130652699) is 3-(cyclobutylmethylamino)oxolan-2-one.
What is the SMILES notation for 3-(cyclobutylmethylamino)oxolan-2-one?
The canonical SMILES for 3-(cyclobutylmethylamino)oxolan-2-one is O=C1OCCC1NCC1CCC1.
What is the InChIKey of 3-(cyclobutylmethylamino)oxolan-2-one?
The InChIKey is AMITXLPKUDHYOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c11-9-8(4-5-12-9)10-6-7-2-1-3-7/h7-8,10H,1-6H2.
What are the key properties of 3-(cyclobutylmethylamino)oxolan-2-one?
3-(cyclobutylmethylamino)oxolan-2-one has a molecular weight of 169.22 g/mol, XLogP of 0.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethylamino)oxolan-2-one is sourced from PubChem (CID 130652699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).