(4R)-4-(methylsulfanylmethyl)azetidin-2-one

C5H9NOS — CID 20641349

IUPAC(4R)-4-(methylsulfanylmethyl)azetidin-2-one
SMILESCSC[C@H]1CC(=O)N1
InChIInChI=1S/C5H9NOS/c1-8-3-4-2-5(7)6-4/h4H,2-3H2,1H3,(H,6,7)/t4-/m1/s1
InChIKeyGYXZGJUHAUJMRW-SCSAIBSYSA-N
MW131.20 g/mol
LogP0.24
Rot. Bonds2

About (4R)-4-(methylsulfanylmethyl)azetidin-2-one

(4R)-4-(methylsulfanylmethyl)azetidin-2-one (PubChem CID 20641349) has the molecular formula C5H9NOS and a molecular weight of 131.20 g/mol. Its IUPAC name is (4R)-4-(methylsulfanylmethyl)azetidin-2-one.

Molecular Properties

Compound Name(4R)-4-(methylsulfanylmethyl)azetidin-2-one
PubChem CID20641349
Molecular FormulaC5H9NOS
Molecular Weight131.20 g/mol
Exact Mass131.04
IUPAC Name(4R)-4-(methylsulfanylmethyl)azetidin-2-one
SMILESCSC[C@H]1CC(=O)N1
InChIInChI=1S/C5H9NOS/c1-8-3-4-2-5(7)6-4/h4H,2-3H2,1H3,(H,6,7)/t4-/m1/s1
InChIKeyGYXZGJUHAUJMRW-SCSAIBSYSA-N
XLogP0.24
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.20
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-4-(methylsulfanylmethyl)azetidin-2-one?
The IUPAC name of (4R)-4-(methylsulfanylmethyl)azetidin-2-one (CID 20641349) is (4R)-4-(methylsulfanylmethyl)azetidin-2-one.
What is the SMILES notation for (4R)-4-(methylsulfanylmethyl)azetidin-2-one?
The canonical SMILES for (4R)-4-(methylsulfanylmethyl)azetidin-2-one is CSC[C@H]1CC(=O)N1.
What is the InChIKey of (4R)-4-(methylsulfanylmethyl)azetidin-2-one?
The InChIKey is GYXZGJUHAUJMRW-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H9NOS/c1-8-3-4-2-5(7)6-4/h4H,2-3H2,1H3,(H,6,7)/t4-/m1/s1.
What are the key properties of (4R)-4-(methylsulfanylmethyl)azetidin-2-one?
(4R)-4-(methylsulfanylmethyl)azetidin-2-one has a molecular weight of 131.20 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(methylsulfanylmethyl)azetidin-2-one is sourced from PubChem (CID 20641349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).