2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide

C10H8F3NO — CID 144539030

IUPAC2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CC1(F)F
InChIInChI=1S/C10H8F3NO/c11-6-1-3-7(4-2-6)14-9(15)8-5-10(8,12)13/h1-4,8H,5H2,(H,14,15)
InChIKeyULJVJWSBVGEAOW-UHFFFAOYSA-N
MW215.17 g/mol
LogP2.42
Rot. Bonds2

About 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide

2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide (PubChem CID 144539030) has the molecular formula C10H8F3NO and a molecular weight of 215.17 g/mol. Its IUPAC name is 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide
PubChem CID144539030
Molecular FormulaC10H8F3NO
Molecular Weight215.17 g/mol
Exact Mass215.06
IUPAC Name2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CC1(F)F
InChIInChI=1S/C10H8F3NO/c11-6-1-3-7(4-2-6)14-9(15)8-5-10(8,12)13/h1-4,8H,5H2,(H,14,15)
InChIKeyULJVJWSBVGEAOW-UHFFFAOYSA-N
XLogP2.42
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.17
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-fluorophenyl)cyclopropanecarboxamide
CID 532027
(1R)-N-(4-fluorophenyl)-2,2-diphenylcyclopropane-1-carboxamide
CID 7432800
(1S)-N-(4-fluorophenyl)-2,2-diphenylcyclopropane-1-carboxamide
CID 7432802
(2S)-1-N,2-N-bis(4-fluorophenyl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 21177965
4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
CID 109150302
(1S)-N-(4-acetamidophenyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 6932479
4-N-(3,5-dimethylphenyl)-1-N-(4-fluorophenyl)cyclohexane-1,4-dicarboxamide
CID 109150694
(1S,4Z,8S)-N-(4-fluorophenyl)bicyclo[6.1.0]non-4-ene-9-carboxamide
CID 5415413
4-(carbamoylamino)-N-(4-fluorophenyl)cyclohexane-1-carboxamide
CID 47069861
(1R,6R)-6-[(4-fluorophenyl)carbamoyl]-3,4-dimethylcyclohex-3-ene-1-carboxylic acid
CID 802021
N-(4-fluorophenyl)pyrazolidine-3-carboxamide
CID 75220517
(2R,3S)-3-[(4-fluorophenyl)carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
CID 40636498

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide?
The IUPAC name of 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide (CID 144539030) is 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide is O=C(Nc1ccc(F)cc1)C1CC1(F)F.
What is the InChIKey of 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide?
The InChIKey is ULJVJWSBVGEAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F3NO/c11-6-1-3-7(4-2-6)14-9(15)8-5-10(8,12)13/h1-4,8H,5H2,(H,14,15).
What are the key properties of 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide?
2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide has a molecular weight of 215.17 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-(4-fluorophenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 144539030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).