N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide

C10H10F3NO2 — CID 61062106

IUPACN-[4-(difluoromethoxy)-3-fluorophenyl]propanamide
SMILESCCC(=O)Nc1ccc(OC(F)F)c(F)c1
InChIInChI=1S/C10H10F3NO2/c1-2-9(15)14-6-3-4-8(7(11)5-6)16-10(12)13/h3-5,10H,2H2,1H3,(H,14,15)
InChIKeyRQHZHWDYIPDYMS-UHFFFAOYSA-N
MW233.19 g/mol
LogP2.78
Rot. Bonds4

About N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide

N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide (PubChem CID 61062106) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide.

Molecular Properties

Compound NameN-[4-(difluoromethoxy)-3-fluorophenyl]propanamide
PubChem CID61062106
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC NameN-[4-(difluoromethoxy)-3-fluorophenyl]propanamide
SMILESCCC(=O)Nc1ccc(OC(F)F)c(F)c1
InChIInChI=1S/C10H10F3NO2/c1-2-9(15)14-6-3-4-8(7(11)5-6)16-10(12)13/h3-5,10H,2H2,1H3,(H,14,15)
InChIKeyRQHZHWDYIPDYMS-UHFFFAOYSA-N
XLogP2.78
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide 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

2-chloro-N-[4-(difluoromethoxy)-3-fluorophenyl]acetamide
CID 60807874
3-amino-N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide;hydrochloride
CID 119295358
1-[4-(difluoromethoxy)-3-fluorophenyl]-3-propan-2-ylurea
CID 47261837
2-amino-N-[4-(difluoromethoxy)-3-fluorophenyl]-3-methylpentanamide;hydrochloride
CID 119734387
N-(3,4-difluorophenyl)propanamide
CID 4285365
N-[2-[[4-(difluoromethoxy)-3-fluorophenyl]carbamoylamino]ethyl]acetamide
CID 51085552
2-hydroxyethyl N-[4-(difluoromethoxy)-3-fluorophenyl]carbamate
CID 79346339
2-[4-(difluoromethoxy)-3-fluoroanilino]butanoic acid
CID 115353116
4-(difluoromethoxy)-3-fluoro-N-propylaniline
CID 60942479
N-[4-(difluoromethoxy)-3-fluorophenyl]-2-ethylpyrrolidine-2-carboxamide
CID 83063094
N-[4-(difluoromethoxy)-3-fluorophenyl]-2,4-dimethylbenzamide
CID 87025999
N-[4-(difluoromethoxy)-3-fluorophenyl]-2-phenylmethoxypropanamide
CID 87026041

Frequently Asked Questions

What is the IUPAC name of N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide?
The IUPAC name of N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide (CID 61062106) is N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide.
What is the SMILES notation for N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide?
The canonical SMILES for N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide is CCC(=O)Nc1ccc(OC(F)F)c(F)c1.
What is the InChIKey of N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide?
The InChIKey is RQHZHWDYIPDYMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2/c1-2-9(15)14-6-3-4-8(7(11)5-6)16-10(12)13/h3-5,10H,2H2,1H3,(H,14,15).
What are the key properties of N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide?
N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide has a molecular weight of 233.19 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(difluoromethoxy)-3-fluorophenyl]propanamide is sourced from PubChem (CID 61062106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).