2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide

C13H18N2O2 — CID 64612053

IUPAC2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide
SMILESCOc1ccc(NC(=O)CC2CNC2)c(C)c1
InChIInChI=1S/C13H18N2O2/c1-9-5-11(17-2)3-4-12(9)15-13(16)6-10-7-14-8-10/h3-5,10,14H,6-8H2,1-2H3,(H,15,16)
InChIKeyMMEADDKBENNCLU-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.55
Rot. Bonds4

About 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide

2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide (PubChem CID 64612053) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide
PubChem CID64612053
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide
SMILESCOc1ccc(NC(=O)CC2CNC2)c(C)c1
InChIInChI=1S/C13H18N2O2/c1-9-5-11(17-2)3-4-12(9)15-13(16)6-10-7-14-8-10/h3-5,10,14H,6-8H2,1-2H3,(H,15,16)
InChIKeyMMEADDKBENNCLU-UHFFFAOYSA-N
XLogP1.55
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(4-methoxy-2-methylphenyl)acetamide
CID 62948733
2-(azetidin-3-yl)-N-(2-methylphenyl)acetamide
CID 64615932
N-(4-methoxy-2-methylphenyl)-3-oxobutanamide
CID 20565334
(3S,4S)-N-(4-methoxy-2-methylphenyl)-4-methylpyrrolidine-3-carboxamide
CID 114084896
N,N'-bis(4-methoxy-2-methylphenyl)decanediamide
CID 10836848
3-amino-N-(4-methoxy-2-methylphenyl)-3-sulfanylidenepropanamide
CID 62872080
N-(4-methoxy-2-methylphenyl)-2-(4-methylphenyl)acetamide
CID 17087411
N-(4-methoxy-2-methylphenyl)-2-[1-(2-methoxypyrimidin-4-yl)piperidin-4-yl]acetamide
CID 53189262
N-(4-methoxy-2-methylphenyl)-3-(4-methoxyphenyl)propanamide
CID 17173046
2-anilino-N-(4-methoxy-2-methylphenyl)acetamide
CID 62871353
N-(4-methoxy-2-methylphenyl)-2-(4-sulfanylphenyl)acetamide
CID 107028761
2-(azetidin-3-yl)-N-(2-bromo-5-methylphenyl)acetamide
CID 82756641

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide (CID 64612053) is 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide is COc1ccc(NC(=O)CC2CNC2)c(C)c1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
The InChIKey is MMEADDKBENNCLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-9-5-11(17-2)3-4-12(9)15-13(16)6-10-7-14-8-10/h3-5,10,14H,6-8H2,1-2H3,(H,15,16).
What are the key properties of 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide?
2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide has a molecular weight of 234.30 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(4-methoxy-2-methylphenyl)acetamide is sourced from PubChem (CID 64612053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).