2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide

C13H18N2O2 — CID 64609788

IUPAC2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccccc1N(C)C(=O)CC1CNC1
InChIInChI=1S/C13H18N2O2/c1-15(13(16)7-10-8-14-9-10)11-5-3-4-6-12(11)17-2/h3-6,10,14H,7-9H2,1-2H3
InChIKeyNLDWFHXTXZPKKW-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.27
Rot. Bonds4

About 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide

2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide (PubChem CID 64609788) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide
PubChem CID64609788
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccccc1N(C)C(=O)CC1CNC1
InChIInChI=1S/C13H18N2O2/c1-15(13(16)7-10-8-14-9-10)11-5-3-4-6-12(11)17-2/h3-6,10,14H,7-9H2,1-2H3
InChIKeyNLDWFHXTXZPKKW-UHFFFAOYSA-N
XLogP1.27
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azetidin-3-yl)-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 64610785
N-(2-methoxyphenyl)-N-methyl-2-(3-methylazetidin-3-yl)oxyacetamide
CID 102611367
2-(azetidin-3-yl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide
CID 65488021
3-amino-N-(2-methoxyphenyl)-N-methylpropanamide
CID 28795107
N-(2-methoxyphenyl)-N-methyl-3-oxopentanamide
CID 59676019
N-(2-methoxyphenyl)-N-methylpiperazine-2-carboxamide
CID 63104359
N-[(1R)-1-(2-methoxyphenyl)ethyl]-N-methyl-2-[(3R)-pyrrolidin-3-yl]acetamide
CID 124514172
3-amino-N-(2-methoxyphenyl)-N,3-dimethylbutanamide
CID 64678245
N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide
CID 66188008
1-[(2-methoxyphenyl)-methylcarbamoyl]cyclobutane-1-carboxylic acid
CID 62097334
N-(2-methoxyphenyl)-N-methyl-2-(2,2,2-trifluoroethylamino)acetamide
CID 78931832
4-ethyl-N-(2-methoxyphenyl)-N-methylpiperidine-4-carboxamide
CID 63129012

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide (CID 64609788) is 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide is COc1ccccc1N(C)C(=O)CC1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide?
The InChIKey is NLDWFHXTXZPKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-15(13(16)7-10-8-14-9-10)11-5-3-4-6-12(11)17-2/h3-6,10,14H,7-9H2,1-2H3.
What are the key properties of 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide?
2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide has a molecular weight of 234.30 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(2-methoxyphenyl)-N-methylacetamide is sourced from PubChem (CID 64609788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).