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

C13H18N2O2 — CID 66188008

IUPACN-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccccc1CC(=O)N(C)C1CNC1
InChIInChI=1S/C13H18N2O2/c1-15(11-8-14-9-11)13(16)7-10-5-3-4-6-12(10)17-2/h3-6,11,14H,7-9H2,1-2H3
InChIKeySMGAFMHAWLKHRX-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.67
Rot. Bonds4

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

N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide (PubChem CID 66188008) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide
PubChem CID66188008
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC NameN-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide
SMILESCOc1ccccc1CC(=O)N(C)C1CNC1
InChIInChI=1S/C13H18N2O2/c1-15(11-8-14-9-11)13(16)7-10-5-3-4-6-12(10)17-2/h3-6,11,14H,7-9H2,1-2H3
InChIKeySMGAFMHAWLKHRX-UHFFFAOYSA-N
XLogP0.67
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 ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyphenyl)-N-[2-[[2-(2-methoxyphenyl)acetyl]-methylamino]cyclohexyl]-N-methylacetamide
CID 71910234
N-(1-acetylpiperidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide
CID 154878066
2-(azetidin-3-yl)-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 64610785
N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylazetidin-3-amine
CID 65486084
2-(azetidin-3-yl)-N-[1-(2-methoxyphenyl)propan-2-yl]-N-methylacetamide
CID 65488021
2-(2,5-dimethoxyphenyl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119552036
2-(2-methoxyphenoxy)-N-methyl-N-[(3R)-pyrrolidin-3-yl]acetamide
CID 94803435
2-(5-bromo-2-methoxyphenyl)-N-methyl-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119552111
2-(2-methoxyphenyl)-N-methyl-N-[(3R)-1-pyridin-2-ylpiperidin-3-yl]acetamide
CID 124987309
2-[azetidin-3-yl(propyl)amino]-N-[(2-methoxyphenyl)methyl]acetamide
CID 66216510
N-(azetidin-3-yl)-N-ethyl-2-methoxybenzamide
CID 66182739
N-cyclopropyl-2-(2-methoxyphenyl)-N-(pyrrolidin-2-ylmethyl)acetamide
CID 104974150

Frequently Asked Questions

What is the IUPAC name of N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide?
The IUPAC name of N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide (CID 66188008) is N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide.
What is the SMILES notation for N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide?
The canonical SMILES for N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide is COc1ccccc1CC(=O)N(C)C1CNC1.
What is the InChIKey of N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide?
The InChIKey is SMGAFMHAWLKHRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-15(11-8-14-9-11)13(16)7-10-5-3-4-6-12(10)17-2/h3-6,11,14H,7-9H2,1-2H3.
What are the key properties of N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide?
N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide has a molecular weight of 234.30 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(azetidin-3-yl)-2-(2-methoxyphenyl)-N-methylacetamide is sourced from PubChem (CID 66188008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).