2,3-difluoro-N-methylaniline

C7H7F2N — CID 50998712

IUPAC2,3-difluoro-N-methylaniline
SMILESCNc1cccc(F)c1F
InChIInChI=1S/C7H7F2N/c1-10-6-4-2-3-5(8)7(6)9/h2-4,10H,1H3
InChIKeyZULZSZSNTGKQDZ-UHFFFAOYSA-N
MW143.14 g/mol
LogP2.01
Rot. Bonds1

About 2,3-difluoro-N-methylaniline

2,3-difluoro-N-methylaniline (PubChem CID 50998712) has the molecular formula C7H7F2N and a molecular weight of 143.14 g/mol. Its IUPAC name is 2,3-difluoro-N-methylaniline.

Molecular Properties

Compound Name2,3-difluoro-N-methylaniline
PubChem CID50998712
Molecular FormulaC7H7F2N
Molecular Weight143.14 g/mol
Exact Mass143.05
IUPAC Name2,3-difluoro-N-methylaniline
SMILESCNc1cccc(F)c1F
InChIInChI=1S/C7H7F2N/c1-10-6-4-2-3-5(8)7(6)9/h2-4,10H,1H3
InChIKeyZULZSZSNTGKQDZ-UHFFFAOYSA-N
XLogP2.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2,3-difluoro-N-methylaniline 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-fluoro-N,3-dimethylaniline
CID 50998713
3-fluoro-1-N,2-N-dimethylbenzene-1,2-diamine
CID 69472911
N-(2,3-difluorophenyl)-2-(methylamino)benzenesulfonamide
CID 62146722
ethane;2,3,4-trifluoro-N-methylaniline
CID 157043663
3-(chloromethyl)-2-fluoro-N-methylaniline
CID 121314539
4-N-(2,3-difluorophenyl)-6-N-methylpyrimidine-4,6-diamine
CID 80797193
1,2,3-trifluorobenzene
CID 15147
2-fluoro-N-methyl-3-(2-methylphenyl)aniline
CID 144912363
N-(2,3-difluorophenyl)ethanesulfonamide
CID 64586893
2,4-difluoro-N,3-dimethylaniline
CID 134441747
4-N-(2,3-difluorophenyl)-5-ethyl-6-N-methylpyrimidine-4,6-diamine
CID 80798019
N-benzyl-2,3-difluoroaniline
CID 21321341

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-N-methylaniline?
The IUPAC name of 2,3-difluoro-N-methylaniline (CID 50998712) is 2,3-difluoro-N-methylaniline.
What is the SMILES notation for 2,3-difluoro-N-methylaniline?
The canonical SMILES for 2,3-difluoro-N-methylaniline is CNc1cccc(F)c1F.
What is the InChIKey of 2,3-difluoro-N-methylaniline?
The InChIKey is ZULZSZSNTGKQDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F2N/c1-10-6-4-2-3-5(8)7(6)9/h2-4,10H,1H3.
What are the key properties of 2,3-difluoro-N-methylaniline?
2,3-difluoro-N-methylaniline has a molecular weight of 143.14 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-N-methylaniline is sourced from PubChem (CID 50998712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).