(3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one

C7H13NO2 — CID 11768687

IUPAC(3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one
SMILESCC[C@@H]1C(=O)N[C@@H]1CCO
InChIInChI=1S/C7H13NO2/c1-2-5-6(3-4-9)8-7(5)10/h5-6,9H,2-4H2,1H3,(H,8,10)/t5-,6+/m0/s1
InChIKeyGJNRPRGXKOZENU-NTSWFWBYSA-N
MW143.19 g/mol
LogP-0.11
Rot. Bonds3

About (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one

(3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one (PubChem CID 11768687) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one.

Molecular Properties

Compound Name(3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one
PubChem CID11768687
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC Name(3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one
SMILESCC[C@@H]1C(=O)N[C@@H]1CCO
InChIInChI=1S/C7H13NO2/c1-2-5-6(3-4-9)8-7(5)10/h5-6,9H,2-4H2,1H3,(H,8,10)/t5-,6+/m0/s1
InChIKeyGJNRPRGXKOZENU-NTSWFWBYSA-N
XLogP-0.11
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-Hydroxypropyl)azetidin-2-one
CID 55301937
(3s,4s)-3-Ethyl-4-hydroxyethyl-azetidinone
CID 13619049
4-(2-Hydroxyethyl)-2-azetidinone
CID 12769226
(4R)-4-(2-Hydroxyethyl)azetidin-2-one
CID 12769227
3-Isopropyl-4-(2-hydroxyethyl)azetidinone
CID 13051147
(3R,4R)-4-(2-hydroxyethyl)-3-propan-2-ylazetidin-2-one
CID 13051148
3-Ethyl-4-(2-hydroxyethyl)-azetidin-2-one
CID 13619047
(3R,4S)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one
CID 13619048
2-(3-Ethyl-4-oxoazetidin-2-yl)acetic acid
CID 13970774
2-[(2R,3R)-3-ethyl-4-oxoazetidin-2-yl]acetic acid
CID 13970775
2-[(2S,3R)-3-ethyl-4-oxoazetidin-2-yl]acetic acid
CID 13970776
4-(2-Hydroxyethyl)-3-methylazetidin-2-one
CID 14328998

Frequently Asked Questions

What is the IUPAC name of (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one?
The IUPAC name of (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one (CID 11768687) is (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one.
What is the SMILES notation for (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one?
The canonical SMILES for (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one is CC[C@@H]1C(=O)N[C@@H]1CCO.
What is the InChIKey of (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one?
The InChIKey is GJNRPRGXKOZENU-NTSWFWBYSA-N. The full InChI is InChI=1S/C7H13NO2/c1-2-5-6(3-4-9)8-7(5)10/h5-6,9H,2-4H2,1H3,(H,8,10)/t5-,6+/m0/s1.
What are the key properties of (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one?
(3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one has a molecular weight of 143.19 g/mol, XLogP of -0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,4R)-3-ethyl-4-(2-hydroxyethyl)azetidin-2-one is sourced from PubChem (CID 11768687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).