2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide

C12H15ClN2O — CID 66254744

IUPAC2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide
SMILESCc1cccc(Cl)c1NC(=O)CC1CNC1
InChIInChI=1S/C12H15ClN2O/c1-8-3-2-4-10(13)12(8)15-11(16)5-9-6-14-7-9/h2-4,9,14H,5-7H2,1H3,(H,15,16)
InChIKeyJMTGPILXEVHWHJ-UHFFFAOYSA-N
MW238.72 g/mol
LogP2.20
Rot. Bonds3

About 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide

2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide (PubChem CID 66254744) has the molecular formula C12H15ClN2O and a molecular weight of 238.72 g/mol. Its IUPAC name is 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide
PubChem CID66254744
Molecular FormulaC12H15ClN2O
Molecular Weight238.72 g/mol
Exact Mass238.09
IUPAC Name2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide
SMILESCc1cccc(Cl)c1NC(=O)CC1CNC1
InChIInChI=1S/C12H15ClN2O/c1-8-3-2-4-10(13)12(8)15-11(16)5-9-6-14-7-9/h2-4,9,14H,5-7H2,1H3,(H,15,16)
InChIKeyJMTGPILXEVHWHJ-UHFFFAOYSA-N
XLogP2.20
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.72
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(azetidin-3-yl)-N-(2,6-dichlorophenyl)acetamide
CID 65469553
2-(azetidin-3-yl)-N-(2,6-dichloro-3-methylphenyl)acetamide
CID 64618728
2-[[2-(azetidin-3-yl)acetyl]amino]-6-chlorobenzoic acid
CID 64612265
2-[(2-chloro-6-methylphenyl)carbamoylamino]-N-(cyclopropylmethyl)acetamide
CID 86795692
[2-(2-chloro-6-methylanilino)-2-oxoethyl]-[2-(2,6-dimethylanilino)-2-oxoethyl]-dimethylazanium
CID 20801
N-(2-chloro-6-methylphenyl)-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 24832627
N-(3-acetamidophenyl)-2-(azetidin-3-yl)acetamide
CID 64617559
N-(2-chloro-6-methylphenyl)-4-methylsulfonylbutanamide
CID 71973311
2-[(2-cyclopropylacetyl)amino]-3-methylbenzoic acid
CID 43358339
3-amino-N-(2-chloro-6-methylphenyl)butanamide;hydrochloride
CID 12546926
2-(4-aminophenyl)-N-(2-chloro-6-methylphenyl)acetamide
CID 66253342
3-[azetidin-3-yl(methyl)amino]-N-(2,6-dichlorophenyl)propanamide
CID 66185509

Frequently Asked Questions

What is the IUPAC name of 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide?
The IUPAC name of 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide (CID 66254744) is 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide.
What is the SMILES notation for 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide?
The canonical SMILES for 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide is Cc1cccc(Cl)c1NC(=O)CC1CNC1.
What is the InChIKey of 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide?
The InChIKey is JMTGPILXEVHWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O/c1-8-3-2-4-10(13)12(8)15-11(16)5-9-6-14-7-9/h2-4,9,14H,5-7H2,1H3,(H,15,16).
What are the key properties of 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide?
2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide has a molecular weight of 238.72 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azetidin-3-yl)-N-(2-chloro-6-methylphenyl)acetamide is sourced from PubChem (CID 66254744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).