N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide

C13H15Cl2NO — CID 69301683

IUPACN-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide
SMILESCCC(=O)N(Cc1cccc(Cl)c1Cl)C1CC1
InChIInChI=1S/C13H15Cl2NO/c1-2-12(17)16(10-6-7-10)8-9-4-3-5-11(14)13(9)15/h3-5,10H,2,6-8H2,1H3
InChIKeyDLGGFVQXRWKKOP-UHFFFAOYSA-N
MW272.17 g/mol
LogP3.89
Rot. Bonds4

About N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide

N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide (PubChem CID 69301683) has the molecular formula C13H15Cl2NO and a molecular weight of 272.17 g/mol. Its IUPAC name is N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide
PubChem CID69301683
Molecular FormulaC13H15Cl2NO
Molecular Weight272.17 g/mol
Exact Mass271.05
IUPAC NameN-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide
SMILESCCC(=O)N(Cc1cccc(Cl)c1Cl)C1CC1
InChIInChI=1S/C13H15Cl2NO/c1-2-12(17)16(10-6-7-10)8-9-4-3-5-11(14)13(9)15/h3-5,10H,2,6-8H2,1H3
InChIKeyDLGGFVQXRWKKOP-UHFFFAOYSA-N
XLogP3.89
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.17
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2,3-dichlorophenyl)methyl]-2-methyl-N-piperidin-4-ylpropanamide
CID 11587945
N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]pyridine-3-carboxamide
CID 154454654
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]propanamide
CID 61061495
acetaldehyde;N-[(2,3-dichlorophenyl)methyl]-N-methylcyclopropanamine;ethane
CID 143260168
4-N-[(2,3-dichlorophenyl)methyl]-4-N-methylcyclohexane-1,4-diamine
CID 79122016
2-amino-N-[(2,3-dichlorophenyl)methyl]-N-ethylacetamide
CID 66568409
(2,3-dichlorophenyl)methyl-methylcarbamic acid
CID 23189896
2-(cyclopentylamino)-N-[(2,3-dichlorophenyl)methyl]-N-methylacetamide
CID 60686913
3-(2-chlorophenyl)-N-cyclopropyl-N-ethylpropanamide
CID 51113060
N-[(2-chlorophenyl)methyl]-N-cyclopentyl-2-(methylamino)acetamide
CID 119776374
(3R,4S,5S)-N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]-5-methyl-4-(3-phenylphenyl)piperidine-3-carboxamide
CID 59375287
1-(4-tert-butylcyclohexyl)-2-(2,3-dichlorophenyl)ethanone
CID 107307912

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide?
The IUPAC name of N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide (CID 69301683) is N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide.
What is the SMILES notation for N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide?
The canonical SMILES for N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide is CCC(=O)N(Cc1cccc(Cl)c1Cl)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide?
The InChIKey is DLGGFVQXRWKKOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2NO/c1-2-12(17)16(10-6-7-10)8-9-4-3-5-11(14)13(9)15/h3-5,10H,2,6-8H2,1H3.
What are the key properties of N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide?
N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide has a molecular weight of 272.17 g/mol, XLogP of 3.89, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]propanamide is sourced from PubChem (CID 69301683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).