N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide

C19H16F2N2O2 — CID 56764445

IUPACN-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide
SMILESO=C(Nc1cccc(OC(F)F)c1)C(c1ccccc1)n1cccc1
InChIInChI=1S/C19H16F2N2O2/c20-19(21)25-16-10-6-9-15(13-16)22-18(24)17(23-11-4-5-12-23)14-7-2-1-3-8-14/h1-13,17,19H,(H,22,24)
InChIKeyGWOKJHIWJTZVHS-UHFFFAOYSA-N
MW342.35 g/mol
LogP4.32
Rot. Bonds6

About N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide

N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide (PubChem CID 56764445) has the molecular formula C19H16F2N2O2 and a molecular weight of 342.35 g/mol. Its IUPAC name is N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide.

Molecular Properties

Compound NameN-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide
PubChem CID56764445
Molecular FormulaC19H16F2N2O2
Molecular Weight342.35 g/mol
Exact Mass342.12
IUPAC NameN-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide
SMILESO=C(Nc1cccc(OC(F)F)c1)C(c1ccccc1)n1cccc1
InChIInChI=1S/C19H16F2N2O2/c20-19(21)25-16-10-6-9-15(13-16)22-18(24)17(23-11-4-5-12-23)14-7-2-1-3-8-14/h1-13,17,19H,(H,22,24)
InChIKeyGWOKJHIWJTZVHS-UHFFFAOYSA-N
XLogP4.32
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.35
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(difluoromethoxy)phenyl]-2-(methylamino)propanamide
CID 62638211
(2S)-2-amino-N-[3-(difluoromethoxy)phenyl]propanamide
CID 61146338
(2R)-N-(4-bromo-3-methylphenyl)-2-phenyl-2-pyrrol-1-ylacetamide
CID 95367609
(2S)-2-amino-N-[3-(difluoromethoxy)phenyl]propanamide;hydrochloride
CID 119280792
(2S)-2-amino-N-[3-(difluoromethoxy)phenyl]-3-methylbutanamide
CID 61178920
2-amino-N-[3-(difluoromethoxy)phenyl]-3,3-dimethylbutanamide
CID 76887533
3-amino-N-[3-(difluoromethoxy)phenyl]-2-methoxypropanamide
CID 114144924
(2S,3S)-2-amino-N-[3-(difluoromethoxy)phenyl]-3-methylpentanamide
CID 61179102
[3-(difluoromethoxy)phenyl]thiourea
CID 51000160
N-(2-chlorophenyl)-2-phenyl-2-pyrrol-1-ylacetamide
CID 52992841
1-[3-(difluoromethoxy)phenyl]-3-[[2-(pyrazol-1-ylmethyl)phenyl]methyl]urea
CID 55738450
(2S)-N-benzhydryl-2-phenyl-2-pyrrol-1-ylacetamide
CID 95367608

Frequently Asked Questions

What is the IUPAC name of N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide?
The IUPAC name of N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide (CID 56764445) is N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide.
What is the SMILES notation for N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide?
The canonical SMILES for N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide is O=C(Nc1cccc(OC(F)F)c1)C(c1ccccc1)n1cccc1.
What is the InChIKey of N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide?
The InChIKey is GWOKJHIWJTZVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N2O2/c20-19(21)25-16-10-6-9-15(13-16)22-18(24)17(23-11-4-5-12-23)14-7-2-1-3-8-14/h1-13,17,19H,(H,22,24).
What are the key properties of N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide?
N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide has a molecular weight of 342.35 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(difluoromethoxy)phenyl]-2-phenyl-2-pyrrol-1-ylacetamide is sourced from PubChem (CID 56764445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).