2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide

C14H15FN2O — CID 110773542

IUPAC2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide
SMILESCc1cc(CC(=O)Nc2ccccc2F)c(C)[nH]1
InChIInChI=1S/C14H15FN2O/c1-9-7-11(10(2)16-9)8-14(18)17-13-6-4-3-5-12(13)15/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKeyHCFGTUIMHQEYKF-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.95
Rot. Bonds3

About 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide

2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide (PubChem CID 110773542) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide
PubChem CID110773542
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide
SMILESCc1cc(CC(=O)Nc2ccccc2F)c(C)[nH]1
InChIInChI=1S/C14H15FN2O/c1-9-7-11(10(2)16-9)8-14(18)17-13-6-4-3-5-12(13)15/h3-7,16H,8H2,1-2H3,(H,17,18)
InChIKeyHCFGTUIMHQEYKF-UHFFFAOYSA-N
XLogP2.95
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-fluorophenyl)-2-(3-methoxy-4-methylphenyl)acetamide
CID 41484310
N-(2-fluorophenyl)-2-iodoacetamide
CID 12611676
2-(2-ethylanilino)-N-(2-fluorophenyl)acetamide
CID 9105155
N'-(2-fluorophenyl)-N-[(2-methylphenyl)methyl]propanediamide
CID 108945445
N-(2-fluorophenyl)butanamide
CID 849021
N-(2,5-dimethylphenyl)-2-(2-fluorophenyl)acetamide
CID 2596673
2-[(2-ethylphenyl)carbamoylamino]-N-(2-fluorophenyl)acetamide
CID 772197
N'-(2-fluorophenyl)propanediamide
CID 70002209
2-[[2-(2-fluoroanilino)-2-oxoethyl]amino]acetic acid
CID 43466135
N-(2-fluorophenyl)-3-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide
CID 26584303
2-(2,6-dimethylanilino)-N-(2-fluorophenyl)acetamide
CID 54818107
2-(3-ethylpentan-3-ylamino)-N-(2-fluorophenyl)acetamide
CID 65039803

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide (CID 110773542) is 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide is Cc1cc(CC(=O)Nc2ccccc2F)c(C)[nH]1.
What is the InChIKey of 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide?
The InChIKey is HCFGTUIMHQEYKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-9-7-11(10(2)16-9)8-14(18)17-13-6-4-3-5-12(13)15/h3-7,16H,8H2,1-2H3,(H,17,18).
What are the key properties of 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide?
2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide has a molecular weight of 246.28 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dimethyl-1H-pyrrol-3-yl)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 110773542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).