3-amino-1-(2-methoxypropyl)azetidin-2-one

C7H14N2O2 — CID 102702135

IUPAC3-amino-1-(2-methoxypropyl)azetidin-2-one
SMILESCOC(C)CN1CC(N)C1=O
InChIInChI=1S/C7H14N2O2/c1-5(11-2)3-9-4-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3
InChIKeyATAVESSLKBESHM-UHFFFAOYSA-N
MW158.20 g/mol
LogP-0.81
Rot. Bonds3

About 3-amino-1-(2-methoxypropyl)azetidin-2-one

3-amino-1-(2-methoxypropyl)azetidin-2-one (PubChem CID 102702135) has the molecular formula C7H14N2O2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 3-amino-1-(2-methoxypropyl)azetidin-2-one.

Molecular Properties

Compound Name3-amino-1-(2-methoxypropyl)azetidin-2-one
PubChem CID102702135
Molecular FormulaC7H14N2O2
Molecular Weight158.20 g/mol
Exact Mass158.11
IUPAC Name3-amino-1-(2-methoxypropyl)azetidin-2-one
SMILESCOC(C)CN1CC(N)C1=O
InChIInChI=1S/C7H14N2O2/c1-5(11-2)3-9-4-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3
InChIKeyATAVESSLKBESHM-UHFFFAOYSA-N
XLogP-0.81
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 5-0.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3S)-3-amino-2-oxoazetidin-1-yl]-3-methylbutanoic acid
CID 67918002
3-amino-1-(2-ethylhexyl)azetidin-2-one
CID 107819375
5-amino-1-(2-methoxypropyl)-6-methylpiperidin-2-one
CID 130571805
3-(2-methoxypropyl)-2-propan-2-ylimidazolidin-4-one
CID 102702006
4-amino-1-(2,2-dimethoxyethyl)pyrrolidin-2-one
CID 168699407
3-amino-1-[2-(1-methylcyclopentyl)ethyl]azetidin-2-one
CID 126983370
3-amino-1-(4-methylpentyl)pyrrolidin-2-one
CID 63004038
3-amino-1-methylazetidin-2-one
CID 70338843
(3S,4R)-1-[(2S)-2-methoxypropyl]-4-phenylpyrrolidin-3-amine
CID 89188707
1-[(2S)-2-methoxypropyl]-4-phenylpyrrolidin-3-amine
CID 89188709
1,3,5-tris(3-methoxybutyl)-1,3,5-triazinane-2,4,6-trione
CID 174996979
(3S)-3-amino-1-methylazetidin-2-one;hydron
CID 131858386

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(2-methoxypropyl)azetidin-2-one?
The IUPAC name of 3-amino-1-(2-methoxypropyl)azetidin-2-one (CID 102702135) is 3-amino-1-(2-methoxypropyl)azetidin-2-one.
What is the SMILES notation for 3-amino-1-(2-methoxypropyl)azetidin-2-one?
The canonical SMILES for 3-amino-1-(2-methoxypropyl)azetidin-2-one is COC(C)CN1CC(N)C1=O.
What is the InChIKey of 3-amino-1-(2-methoxypropyl)azetidin-2-one?
The InChIKey is ATAVESSLKBESHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2/c1-5(11-2)3-9-4-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3.
What are the key properties of 3-amino-1-(2-methoxypropyl)azetidin-2-one?
3-amino-1-(2-methoxypropyl)azetidin-2-one has a molecular weight of 158.20 g/mol, XLogP of -0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(2-methoxypropyl)azetidin-2-one is sourced from PubChem (CID 102702135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).