N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide

C16H13ClFNO — CID 134055525

IUPACN-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1CC1c1ccccc1F
InChIInChI=1S/C16H13ClFNO/c17-13-6-2-4-8-15(13)19-16(20)12-9-11(12)10-5-1-3-7-14(10)18/h1-8,11-12H,9H2,(H,19,20)
InChIKeyLXAAVMKMYYIPMI-UHFFFAOYSA-N
MW289.74 g/mol
LogP4.22
Rot. Bonds3

About N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide

N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide (PubChem CID 134055525) has the molecular formula C16H13ClFNO and a molecular weight of 289.74 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
PubChem CID134055525
Molecular FormulaC16H13ClFNO
Molecular Weight289.74 g/mol
Exact Mass289.07
IUPAC NameN-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1CC1c1ccccc1F
InChIInChI=1S/C16H13ClFNO/c17-13-6-2-4-8-15(13)19-16(20)12-9-11(12)10-5-1-3-7-14(10)18/h1-8,11-12H,9H2,(H,19,20)
InChIKeyLXAAVMKMYYIPMI-UHFFFAOYSA-N
XLogP4.22
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.74
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-fluorophenyl)-N-naphthalen-1-ylcyclopropane-1-carboxamide
CID 134009901
N-(2-chloro-4-fluorophenyl)-2-(2-chlorophenyl)cyclopropane-1-carboxamide
CID 55476894
trans-(1R,2R)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 97184259
trans-(1S,2S)-N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 97184258
trans-(1R,2R)-2-(2-fluorophenyl)-N-[2-(pyrrolidin-1-ylmethyl)phenyl]cyclopropane-1-carboxamide
CID 97014213
2-(2-chlorophenyl)-N-(2-fluoro-5-methylphenyl)cyclopropane-1-carboxamide
CID 55477032
4-N-(2-chlorophenyl)-1-N-(2-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109150860
cis-(1S,2R)-2-(3,5-dichlorophenyl)-N-(2-fluorophenyl)cyclopropane-1-carboxamide
CID 96564487
trans-(1S,2S)-2-(2-fluorophenyl)-N-(2-methoxy-5-methylphenyl)cyclopropane-1-carboxamide
CID 41036811
methyl 2-[[(1R,2S)-2-(2-fluorophenyl)cyclopropanecarbonyl]amino]-4,5-dimethoxybenzoate
CID 97184245
2-(2-chlorophenyl)-N-[2-(2,2,2-trifluoroethoxy)phenyl]cyclopropane-1-carboxamide
CID 55507970
2-(2-chlorophenyl)-N-(2-propan-2-yloxyphenyl)cyclopropane-1-carboxamide
CID 55689122

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide (CID 134055525) is N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide is O=C(Nc1ccccc1Cl)C1CC1c1ccccc1F.
What is the InChIKey of N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide?
The InChIKey is LXAAVMKMYYIPMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClFNO/c17-13-6-2-4-8-15(13)19-16(20)12-9-11(12)10-5-1-3-7-14(10)18/h1-8,11-12H,9H2,(H,19,20).
What are the key properties of N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide?
N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide has a molecular weight of 289.74 g/mol, XLogP of 4.22, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-(2-fluorophenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 134055525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).