N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide

C19H16F2N2O2 — CID 71085668

IUPACN-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide
SMILESO=C(NC1=C(c2ccccc2)NC(c2ccccc2)O1)C1CC1(F)F
InChIInChI=1S/C19H16F2N2O2/c20-19(21)11-14(19)16(24)23-18-15(12-7-3-1-4-8-12)22-17(25-18)13-9-5-2-6-10-13/h1-10,14,17,22H,11H2,(H,23,24)
InChIKeyGUCHCWIDMVDBIB-UHFFFAOYSA-N
MW342.35 g/mol
LogP3.40
Rot. Bonds4

About N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide

N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide (PubChem CID 71085668) has the molecular formula C19H16F2N2O2 and a molecular weight of 342.35 g/mol. Its IUPAC name is N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide
PubChem CID71085668
Molecular FormulaC19H16F2N2O2
Molecular Weight342.35 g/mol
Exact Mass342.12
IUPAC NameN-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide
SMILESO=C(NC1=C(c2ccccc2)NC(c2ccccc2)O1)C1CC1(F)F
InChIInChI=1S/C19H16F2N2O2/c20-19(21)11-14(19)16(24)23-18-15(12-7-3-1-4-8-12)22-17(25-18)13-9-5-2-6-10-13/h1-10,14,17,22H,11H2,(H,23,24)
InChIKeyGUCHCWIDMVDBIB-UHFFFAOYSA-N
XLogP3.40
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

benzyl N-[6-oxo-6-[[2-(trifluoromethyl)phenyl]methylamino]hexyl]carbamate
CID 6736142
N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-3-(trifluoromethyl)benzamide
CID 71085653
N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-4-fluorobenzamide
CID 71085664
N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2-(trifluoromethyl)benzamide
CID 71085665
N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-1-(trifluoromethyl)cyclopropane-1-carboxamide
CID 71085672
N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-1-[2-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
CID 71085830
N-[(Z)-2-(methylideneamino)-2-phenyl-1-phenylmethoxyethenyl]-1-(trifluoromethyl)cyclopropane-1-carboxamide
CID 143726600
2,2-difluoro-N-[(Z)-2-(methylideneamino)-2-phenyl-1-phenylmethoxyethenyl]cyclopropane-1-carboxamide
CID 143726664
N-methyl-4-phenyl-2-[4-(trifluoromethyl)phenyl]-2,3-dihydro-1,3-oxazol-5-amine;2,2,2-trifluoroacetaldehyde
CID 143726678
benzyl N-[[1-[(4-fluorophenyl)methyl]-5-oxopyrrolidin-3-yl]methyl]carbamate
CID 16919542
benzyl N-[(2S)-3-methyl-1-oxo-1-[[4-(trifluoromethyl)phenyl]methylamino]butan-2-yl]carbamate
CID 25402831
benzyl N-[4-oxo-4-[[4-(2,2,2-trifluoroethoxymethyl)phenyl]methylamino]butyl]carbamate
CID 55824381

Frequently Asked Questions

What is the IUPAC name of N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide?
The IUPAC name of N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide (CID 71085668) is N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide.
What is the SMILES notation for N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide?
The canonical SMILES for N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide is O=C(NC1=C(c2ccccc2)NC(c2ccccc2)O1)C1CC1(F)F.
What is the InChIKey of N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide?
The InChIKey is GUCHCWIDMVDBIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O2/c20-19(21)11-14(19)16(24)23-18-15(12-7-3-1-4-8-12)22-17(25-18)13-9-5-2-6-10-13/h1-10,14,17,22H,11H2,(H,23,24).
What are the key properties of N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide?
N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide has a molecular weight of 342.35 g/mol, XLogP of 3.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-diphenyl-2,3-dihydro-1,3-oxazol-5-yl)-2,2-difluorocyclopropane-1-carboxamide is sourced from PubChem (CID 71085668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).