N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide

C17H15Cl2NO — CID 110439353

IUPACN-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(NC(=O)C2(c3ccccc3Cl)CC2)cc1Cl
InChIInChI=1S/C17H15Cl2NO/c1-11-6-7-12(10-15(11)19)20-16(21)17(8-9-17)13-4-2-3-5-14(13)18/h2-7,10H,8-9H2,1H3,(H,20,21)
InChIKeyGQFNWSIKUXCZHX-UHFFFAOYSA-N
MW320.22 g/mol
LogP4.97
Rot. Bonds3

About N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide

N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide (PubChem CID 110439353) has the molecular formula C17H15Cl2NO and a molecular weight of 320.22 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide
PubChem CID110439353
Molecular FormulaC17H15Cl2NO
Molecular Weight320.22 g/mol
Exact Mass319.05
IUPAC NameN-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(NC(=O)C2(c3ccccc3Cl)CC2)cc1Cl
InChIInChI=1S/C17H15Cl2NO/c1-11-6-7-12(10-15(11)19)20-16(21)17(8-9-17)13-4-2-3-5-14(13)18/h2-7,10H,8-9H2,1H3,(H,20,21)
InChIKeyGQFNWSIKUXCZHX-UHFFFAOYSA-N
XLogP4.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.22
LogP ≤ 54.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3-chloro-4-methylphenyl)-1-(2-methoxyphenyl)cyclobutane-1-carboxamide
CID 110439021
N-(3-chloro-4-methylphenyl)-1-phenylcyclobutane-1-carboxamide
CID 110438526
5-[[4-(2-chlorophenyl)oxane-4-carbonyl]amino]-2-methylbenzoic acid
CID 119255383
N-(3-acetylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide
CID 110439373
4-[[4-(2-chlorophenyl)oxane-4-carbonyl]amino]-2-methylbenzoic acid
CID 119240489
1-(2-chlorophenyl)-N-(4-methoxy-3-methylphenyl)cyclohexane-1-carboxamide
CID 100676610
1-(2-chlorophenyl)-N-(3-methylsulfanylphenyl)cyclopropane-1-carboxamide
CID 110439401
1-(2-chlorophenyl)-N-(4-cyclopentyloxy-3-methylphenyl)cyclopentane-1-carboxamide
CID 100666997
N-(3-fluoro-4-methylphenyl)-1-(2-methylphenyl)cyclopropane-1-carboxamide
CID 155944841
1-amino-N-(3-chloro-4-methylphenyl)cyclopentane-1-carboxamide
CID 60867567
1-N-(3-chloro-4-methylphenyl)-1-N'-(2,3-dichlorophenyl)cyclopropane-1,1-dicarboxamide
CID 108982818
5-[[1-(2-methoxyphenyl)cyclopropanecarbonyl]amino]-2-methylbenzoic acid
CID 119255092

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide (CID 110439353) is N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide is Cc1ccc(NC(=O)C2(c3ccccc3Cl)CC2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide?
The InChIKey is GQFNWSIKUXCZHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2NO/c1-11-6-7-12(10-15(11)19)20-16(21)17(8-9-17)13-4-2-3-5-14(13)18/h2-7,10H,8-9H2,1H3,(H,20,21).
What are the key properties of N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide?
N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide has a molecular weight of 320.22 g/mol, XLogP of 4.97, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-1-(2-chlorophenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 110439353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).