N-(2,6-difluoro-4-methylphenyl)formamide

C8H7F2NO — CID 144501895

IUPACN-(2,6-difluoro-4-methylphenyl)formamide
SMILESCc1cc(F)c(NC=O)c(F)c1
InChIInChI=1S/C8H7F2NO/c1-5-2-6(9)8(11-4-12)7(10)3-5/h2-4H,1H3,(H,11,12)
InChIKeyIECILYNRCFUMGE-UHFFFAOYSA-N
MW171.15 g/mol
LogP1.84
Rot. Bonds2

About N-(2,6-difluoro-4-methylphenyl)formamide

N-(2,6-difluoro-4-methylphenyl)formamide (PubChem CID 144501895) has the molecular formula C8H7F2NO and a molecular weight of 171.15 g/mol. Its IUPAC name is N-(2,6-difluoro-4-methylphenyl)formamide.

Molecular Properties

Compound NameN-(2,6-difluoro-4-methylphenyl)formamide
PubChem CID144501895
Molecular FormulaC8H7F2NO
Molecular Weight171.15 g/mol
Exact Mass171.05
IUPAC NameN-(2,6-difluoro-4-methylphenyl)formamide
SMILESCc1cc(F)c(NC=O)c(F)c1
InChIInChI=1S/C8H7F2NO/c1-5-2-6(9)8(11-4-12)7(10)3-5/h2-4H,1H3,(H,11,12)
InChIKeyIECILYNRCFUMGE-UHFFFAOYSA-N
XLogP1.84
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.15
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-(2,4,6-trifluorophenyl)formamide
CID 19027811
N-(2-fluoro-4-methyl-6-propoxyphenyl)formamide
CID 144684401
N-(2,4-dichloro-6-fluorophenyl)formamide
CID 168654029
(2,6-difluoro-4-methylphenyl)carbamic acid
CID 175535937
N-(2-fluoro-6-formyl-4-methylphenyl)acetamide
CID 84773346
N-(2-fluoro-4,6-dimethylphenyl)acetamide
CID 126993830
3-fluoro-2,5-dimethylbenzaldehyde
CID 84763320
N-(2,6-dichloro-4-fluorophenyl)formamide
CID 15767077
2-cyano-N-(2,6-difluoro-4-methylphenyl)acetamide
CID 168521532
N-[4-(4-formamido-3,5-dimethylphenyl)sulfanyl-2,6-dimethylphenyl]formamide
CID 124926919
N-(3,6-difluoro-2-iodophenyl)formamide
CID 168653677
N-[3-methyl-5-(trifluoromethyl)phenyl]formamide
CID 58761830

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluoro-4-methylphenyl)formamide?
The IUPAC name of N-(2,6-difluoro-4-methylphenyl)formamide (CID 144501895) is N-(2,6-difluoro-4-methylphenyl)formamide.
What is the SMILES notation for N-(2,6-difluoro-4-methylphenyl)formamide?
The canonical SMILES for N-(2,6-difluoro-4-methylphenyl)formamide is Cc1cc(F)c(NC=O)c(F)c1.
What is the InChIKey of N-(2,6-difluoro-4-methylphenyl)formamide?
The InChIKey is IECILYNRCFUMGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F2NO/c1-5-2-6(9)8(11-4-12)7(10)3-5/h2-4H,1H3,(H,11,12).
What are the key properties of N-(2,6-difluoro-4-methylphenyl)formamide?
N-(2,6-difluoro-4-methylphenyl)formamide has a molecular weight of 171.15 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluoro-4-methylphenyl)formamide is sourced from PubChem (CID 144501895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).