2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide

C14H16Cl2N2O2 — CID 47461259

IUPAC2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide
SMILESCC(=O)N(C)CC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1
InChIInChI=1S/C14H16Cl2N2O2/c1-9(19)18(2)8-13(20)17-14(5-6-14)10-3-4-11(15)12(16)7-10/h3-4,7H,5-6,8H2,1-2H3,(H,17,20)
InChIKeyHYKFICSRQOVUSG-UHFFFAOYSA-N
MW315.20 g/mol
LogP2.58
Rot. Bonds4

About 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide

2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide (PubChem CID 47461259) has the molecular formula C14H16Cl2N2O2 and a molecular weight of 315.20 g/mol. Its IUPAC name is 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide.

Molecular Properties

Compound Name2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide
PubChem CID47461259
Molecular FormulaC14H16Cl2N2O2
Molecular Weight315.20 g/mol
Exact Mass314.06
IUPAC Name2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide
SMILESCC(=O)N(C)CC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1
InChIInChI=1S/C14H16Cl2N2O2/c1-9(19)18(2)8-13(20)17-14(5-6-14)10-3-4-11(15)12(16)7-10/h3-4,7H,5-6,8H2,1-2H3,(H,17,20)
InChIKeyHYKFICSRQOVUSG-UHFFFAOYSA-N
XLogP2.58
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.20
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(3,4-dichlorophenyl)ethyl]acetamide
CID 2854245
(2S)-N-[(3,4-dichlorophenyl)methyl]-1-ethyl-5-oxopyrrolidine-2-carboxamide
CID 67458133
2-Oxo-1,2-dihydropyridin-3-yl amide derivative, 6t
CID 44473105
2-Oxo-1,2-dihydropyridin-3-yl amide derivative, 8t
CID 44473111
N-(benzylcarbamoyl)-2-[(3,4-dichlorophenyl)methyl-methylamino]acetamide
CID 2699991
N-benzyl-2-[(3,4-dichlorophenyl)methyl-methylamino]-3-ethylpentanamide
CID 53383999
[(1R)-2-(3,4-dichlorophenyl)-1-[[2-[ethyl(prop-2-enoyl)amino]acetyl]amino]ethyl]boronic acid
CID 140880269
[(1R)-2-(3,4-dichlorophenyl)-1-[[2-[methyl(prop-2-enoyl)amino]acetyl]amino]ethyl]boronic acid
CID 140880275
Acetamide, N-(1-(3,4-dichlorophenyl)propyl)-2-(diethylamino)-
CID 3039074
4-Morpholineacetamide, N-(1-(3,4-dichlorophenyl)propyl)-
CID 3039075
1-Pyrrolidineacetamide, N-(1-(3,4-dichlorophenyl)propyl)-
CID 3039076
1-Piperidineacetamide, N-(1-(3,4-dichlorophenyl)propyl)-
CID 3039077

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide?
The IUPAC name of 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide (CID 47461259) is 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide.
What is the SMILES notation for 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide?
The canonical SMILES for 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide is CC(=O)N(C)CC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1.
What is the InChIKey of 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide?
The InChIKey is HYKFICSRQOVUSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Cl2N2O2/c1-9(19)18(2)8-13(20)17-14(5-6-14)10-3-4-11(15)12(16)7-10/h3-4,7H,5-6,8H2,1-2H3,(H,17,20).
What are the key properties of 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide?
2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide has a molecular weight of 315.20 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(methyl)amino]-N-[1-(3,4-dichlorophenyl)cyclopropyl]acetamide is sourced from PubChem (CID 47461259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).