3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide

C19H19Cl2NO — CID 38937319

IUPAC3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide
SMILESO=C(CCc1cccc(Cl)c1Cl)NCC1(c2ccccc2)CC1
InChIInChI=1S/C19H19Cl2NO/c20-16-8-4-5-14(18(16)21)9-10-17(23)22-13-19(11-12-19)15-6-2-1-3-7-15/h1-8H,9-13H2,(H,22,23)
InChIKeyCFGPJKXXMVJCTL-UHFFFAOYSA-N
MW348.27 g/mol
LogP4.77
Rot. Bonds6

About 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide

3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide (PubChem CID 38937319) has the molecular formula C19H19Cl2NO and a molecular weight of 348.27 g/mol. Its IUPAC name is 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide
PubChem CID38937319
Molecular FormulaC19H19Cl2NO
Molecular Weight348.27 g/mol
Exact Mass347.08
IUPAC Name3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide
SMILESO=C(CCc1cccc(Cl)c1Cl)NCC1(c2ccccc2)CC1
InChIInChI=1S/C19H19Cl2NO/c20-16-8-4-5-14(18(16)21)9-10-17(23)22-13-19(11-12-19)15-6-2-1-3-7-15/h1-8H,9-13H2,(H,22,23)
InChIKeyCFGPJKXXMVJCTL-UHFFFAOYSA-N
XLogP4.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.27
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2,3-dichlorophenyl)-N-phenylpropanamide
CID 38885504
3-amino-N-[(1-phenylcyclopropyl)methyl]propanamide
CID 110460210
2-(2-chloro-6-fluorophenyl)-N-[(1-phenylcyclobutyl)methyl]acetamide
CID 18139443
3-(2-aminophenyl)-N-[[1-(3-fluorophenyl)cyclopropyl]methyl]propanamide;hydrochloride
CID 120611193
2-amino-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 110459326
3-amino-N-[(1-phenylcyclobutyl)methyl]propanamide
CID 110460227
3-oxo-N-[(1-phenylcyclopropyl)methyl]butanamide
CID 110470652
N-[2-oxo-2-[(1-phenylcyclopropyl)methylamino]ethyl]-2-phenylacetamide
CID 42145846
3-(2,3-dichlorophenyl)-N-(2-iodophenyl)propanamide
CID 38886351
N-[2-(3-chloro-2-methylanilino)-2-oxoethyl]-3-(2,3-dichlorophenyl)propanamide
CID 38926559
[2-oxo-2-[(1-phenylcyclopropyl)methylamino]ethyl] 2-(3,4-dichlorophenyl)acetate
CID 30517012
2-(2,4-dichlorophenoxy)-N-[(1-phenylcyclopropyl)methyl]acetamide
CID 42145569

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide?
The IUPAC name of 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide (CID 38937319) is 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide.
What is the SMILES notation for 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide?
The canonical SMILES for 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide is O=C(CCc1cccc(Cl)c1Cl)NCC1(c2ccccc2)CC1.
What is the InChIKey of 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide?
The InChIKey is CFGPJKXXMVJCTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19Cl2NO/c20-16-8-4-5-14(18(16)21)9-10-17(23)22-13-19(11-12-19)15-6-2-1-3-7-15/h1-8H,9-13H2,(H,22,23).
What are the key properties of 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide?
3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide has a molecular weight of 348.27 g/mol, XLogP of 4.77, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dichlorophenyl)-N-[(1-phenylcyclopropyl)methyl]propanamide is sourced from PubChem (CID 38937319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).