2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide

C12H16Cl2N2O — CID 28774942

IUPAC2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CNc1cccc(Cl)c1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-8(2)16(3)11(17)7-15-10-6-4-5-9(13)12(10)14/h4-6,8,15H,7H2,1-3H3
InChIKeyAEIHJZWPBKTCKP-UHFFFAOYSA-N
MW275.18 g/mol
LogP3.27
Rot. Bonds4

About 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide

2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide (PubChem CID 28774942) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide
PubChem CID28774942
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC Name2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide
SMILESCC(C)N(C)C(=O)CNc1cccc(Cl)c1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-8(2)16(3)11(17)7-15-10-6-4-5-9(13)12(10)14/h4-6,8,15H,7H2,1-3H3
InChIKeyAEIHJZWPBKTCKP-UHFFFAOYSA-N
XLogP3.27
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-chloro-2-fluoroanilino)-N-methyl-N-propan-2-ylacetamide
CID 43385741
2-(2-cyanoanilino)-N-methyl-N-propan-2-ylacetamide
CID 28580926
2-(2-cyano-3-methylanilino)-N-methyl-N-propan-2-ylacetamide
CID 107804405
2-(2,6-difluoroanilino)-N-methyl-N-propan-2-ylacetamide
CID 28879085
N-(3-chloro-2-methylphenyl)-2-(2,3-dichloroanilino)acetamide
CID 33162844
2-(2,3-dichloroanilino)-N-[3-(dimethylamino)propyl]acetamide
CID 108995350
N-(4-acetamidophenyl)-2-(2,3-dichloroanilino)acetamide
CID 54816111
2-[acetyl(propan-2-yl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 113158283
2-(3-iodoanilino)-N-methyl-N-propan-2-ylacetamide
CID 28879230
2-(2,3-dichloroanilino)-N-(1-phenylpropyl)acetamide
CID 54815882
3-(2,3-dichlorophenyl)-1-phenyl-1-propan-2-ylurea
CID 3539470
2-(3-chloro-2-fluoroanilino)-N-ethyl-N-methylacetamide
CID 43309689

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide?
The IUPAC name of 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide (CID 28774942) is 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide is CC(C)N(C)C(=O)CNc1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide?
The InChIKey is AEIHJZWPBKTCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O/c1-8(2)16(3)11(17)7-15-10-6-4-5-9(13)12(10)14/h4-6,8,15H,7H2,1-3H3.
What are the key properties of 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide?
2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide has a molecular weight of 275.18 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichloroanilino)-N-methyl-N-propan-2-ylacetamide is sourced from PubChem (CID 28774942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).