N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide

C14H14F2N2O — CID 110688906

IUPACN-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide
SMILESCc1ccc(C)n1CC(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H14F2N2O/c1-9-3-4-10(2)18(9)8-14(19)17-11-5-6-12(15)13(16)7-11/h3-7H,8H2,1-2H3,(H,17,19)
InChIKeyCHHUWIFIZZMJKG-UHFFFAOYSA-N
MW264.28 g/mol
LogP3.02
Rot. Bonds3

About N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide

N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide (PubChem CID 110688906) has the molecular formula C14H14F2N2O and a molecular weight of 264.28 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide
PubChem CID110688906
Molecular FormulaC14H14F2N2O
Molecular Weight264.28 g/mol
Exact Mass264.11
IUPAC NameN-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide
SMILESCc1ccc(C)n1CC(=O)Nc1ccc(F)c(F)c1
InChIInChI=1S/C14H14F2N2O/c1-9-3-4-10(2)18(9)8-14(19)17-11-5-6-12(15)13(16)7-11/h3-7H,8H2,1-2H3,(H,17,19)
InChIKeyCHHUWIFIZZMJKG-UHFFFAOYSA-N
XLogP3.02
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-acetamidophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide
CID 110688871
N,N'-bis(3,4-difluorophenyl)propanediamide
CID 108956967
N-(4-chlorophenyl)-2-(2,6-dimethyl-4-oxo-1-pyridinyl)acetamide
CID 108795047
N-(3,4-difluorophenyl)propanamide
CID 4285365
N,N'-bis(3,4-difluorophenyl)butanediamide
CID 896186
methyl N-[2-(3,4-difluoroanilino)-2-oxoethyl]carbamate
CID 47129041
N-(3,4-difluorophenyl)-2-pyrazol-1-ylacetamide
CID 39724155
N-(2,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide
CID 110688890
N-(4-acetamidophenyl)-2-(2,6-dimethyl-4-oxo-1-pyridinyl)acetamide
CID 108794875
2-amino-N-(3,4-difluorophenyl)acetamide
CID 2410802
ethyl N-[2-(3,4-difluoroanilino)-2-oxoethyl]carbamate
CID 113002353
2-(2,5-dimethylpyrrol-1-yl)-N-(3-methoxyphenyl)acetamide
CID 21383169

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide?
The IUPAC name of N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide (CID 110688906) is N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide?
The canonical SMILES for N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide is Cc1ccc(C)n1CC(=O)Nc1ccc(F)c(F)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide?
The InChIKey is CHHUWIFIZZMJKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-9-3-4-10(2)18(9)8-14(19)17-11-5-6-12(15)13(16)7-11/h3-7H,8H2,1-2H3,(H,17,19).
What are the key properties of N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide?
N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide has a molecular weight of 264.28 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-2-(2,5-dimethylpyrrol-1-yl)acetamide is sourced from PubChem (CID 110688906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).