N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide

C12H14Cl2N2O — CID 54957036

IUPACN-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide
SMILESCN(C(=O)CNc1cc(Cl)cc(Cl)c1)C1CC1
InChIInChI=1S/C12H14Cl2N2O/c1-16(11-2-3-11)12(17)7-15-10-5-8(13)4-9(14)6-10/h4-6,11,15H,2-3,7H2,1H3
InChIKeyGQRHQUIUCLUIJP-UHFFFAOYSA-N
MW273.16 g/mol
LogP3.03
Rot. Bonds4

About N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide

N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide (PubChem CID 54957036) has the molecular formula C12H14Cl2N2O and a molecular weight of 273.16 g/mol. Its IUPAC name is N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide
PubChem CID54957036
Molecular FormulaC12H14Cl2N2O
Molecular Weight273.16 g/mol
Exact Mass272.05
IUPAC NameN-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide
SMILESCN(C(=O)CNc1cc(Cl)cc(Cl)c1)C1CC1
InChIInChI=1S/C12H14Cl2N2O/c1-16(11-2-3-11)12(17)7-15-10-5-8(13)4-9(14)6-10/h4-6,11,15H,2-3,7H2,1H3
InChIKeyGQRHQUIUCLUIJP-UHFFFAOYSA-N
XLogP3.03
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.16
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-methyl-2-(naphthalen-2-ylamino)acetamide
CID 61488971
2-(3,5-dichloroanilino)-N,N-diethylacetamide
CID 28576153
2-[3-bromo-5-(trifluoromethyl)anilino]-N-cyclopropyl-N-methylacetamide
CID 65489038
N-cyclopropyl-N-methyl-2-(thiophen-3-ylamino)acetamide
CID 66350829
N-cyclopropyl-2-(3-ethyl-4-methylanilino)-N-methylacetamide
CID 113355949
2-(3-bromo-4-methylanilino)-N-cyclopropyl-N-methylacetamide
CID 55137262
N-cyclopropyl-N-methyl-2-[(1-methylpyrazol-4-yl)amino]acetamide
CID 79770399
2-(4-bromo-2-chloroanilino)-N-cyclopropyl-N-methylacetamide
CID 54957038
N-(cyclopropylmethyl)-2-(3,5-dichloroanilino)acetamide
CID 28576189
2-(4-chloro-2-methoxy-5-methylanilino)-N-cyclopropyl-N-methylacetamide
CID 61488860
2-anilino-N-methyl-N-(1-methylpiperidin-4-yl)acetamide
CID 54927274
N-cyclohexyl-2-(4-iodoanilino)-N-methylacetamide
CID 54812377

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide?
The IUPAC name of N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide (CID 54957036) is N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide.
What is the SMILES notation for N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide?
The canonical SMILES for N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide is CN(C(=O)CNc1cc(Cl)cc(Cl)c1)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide?
The InChIKey is GQRHQUIUCLUIJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2N2O/c1-16(11-2-3-11)12(17)7-15-10-5-8(13)4-9(14)6-10/h4-6,11,15H,2-3,7H2,1H3.
What are the key properties of N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide?
N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide has a molecular weight of 273.16 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3,5-dichloroanilino)-N-methylacetamide is sourced from PubChem (CID 54957036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).