(2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide

C14H18N2O3 — CID 135267533

IUPAC(2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide
SMILESCN(C)C(=O)[C@]1(COc2ccccc2)CC(=O)N1C
InChIInChI=1S/C14H18N2O3/c1-15(2)13(18)14(9-12(17)16(14)3)10-19-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3/t14-/m1/s1
InChIKeyBSCUUNLJJDGGDL-CQSZACIVSA-N
MW262.31 g/mol
LogP0.75
Rot. Bonds4

About (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide

(2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide (PubChem CID 135267533) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide
PubChem CID135267533
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name(2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide
SMILESCN(C)C(=O)[C@]1(COc2ccccc2)CC(=O)N1C
InChIInChI=1S/C14H18N2O3/c1-15(2)13(18)14(9-12(17)16(14)3)10-19-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3/t14-/m1/s1
InChIKeyBSCUUNLJJDGGDL-CQSZACIVSA-N
XLogP0.75
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 50.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide?
The IUPAC name of (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide (CID 135267533) is (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide.
What is the SMILES notation for (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide?
The canonical SMILES for (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide is CN(C)C(=O)[C@]1(COc2ccccc2)CC(=O)N1C.
What is the InChIKey of (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide?
The InChIKey is BSCUUNLJJDGGDL-CQSZACIVSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-15(2)13(18)14(9-12(17)16(14)3)10-19-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3/t14-/m1/s1.
What are the key properties of (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide?
(2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 0.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N,1-trimethyl-4-oxo-2-(phenoxymethyl)azetidine-2-carboxamide is sourced from PubChem (CID 135267533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).