N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide

C14H10Br2FNO — CID 107598701

IUPACN-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2c(Br)cccc2Br)c1F
InChIInChI=1S/C14H10Br2FNO/c1-8-4-2-5-9(12(8)17)14(19)18-13-10(15)6-3-7-11(13)16/h2-7H,1H3,(H,18,19)
InChIKeyCSPGFYHZTPKJAB-UHFFFAOYSA-N
MW387.05 g/mol
LogP4.91
Rot. Bonds2

About N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide

N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide (PubChem CID 107598701) has the molecular formula C14H10Br2FNO and a molecular weight of 387.05 g/mol. Its IUPAC name is N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide.

Molecular Properties

Compound NameN-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide
PubChem CID107598701
Molecular FormulaC14H10Br2FNO
Molecular Weight387.05 g/mol
Exact Mass384.91
IUPAC NameN-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2c(Br)cccc2Br)c1F
InChIInChI=1S/C14H10Br2FNO/c1-8-4-2-5-9(12(8)17)14(19)18-13-10(15)6-3-7-11(13)16/h2-7H,1H3,(H,18,19)
InChIKeyCSPGFYHZTPKJAB-UHFFFAOYSA-N
XLogP4.91
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.05
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-bromo-6-fluorophenyl)-2,3-difluorobenzamide
CID 103741269
3-bromo-N-(4-bromo-2,6-dimethylphenyl)-2-fluorobenzamide
CID 106545347
N-(4-bromo-2,6-dichlorophenyl)-2-fluoro-3-methylbenzamide
CID 81481515
2-bromo-N-(2-fluoro-3-methylphenyl)benzamide
CID 113351864
N-(3-amino-4-bromophenyl)-2-fluoro-3-methylbenzamide
CID 81481979
3-bromo-N-(2,6-dichlorophenyl)-2-fluorobenzamide
CID 107951647
2-bromo-N-(2,6-difluoro-3-methylphenyl)-3-methylbenzamide
CID 107982586
2-bromo-5-fluoro-N-(2-fluoro-6-methylphenyl)benzamide
CID 115909354
3-bromo-N-(4-bromo-2-methoxy-6-methylphenyl)-2-fluorobenzamide
CID 106545841
methyl 3-[(2-fluoro-3-methylbenzoyl)amino]-4-methylthiophene-2-carboxylate
CID 114915416
N-(3-bromo-4-methoxyphenyl)-2-fluoro-3-methylbenzamide
CID 80712346
3-bromo-N-(2,4-dimethylphenyl)-2-fluorobenzamide
CID 106543986

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide?
The IUPAC name of N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide (CID 107598701) is N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide.
What is the SMILES notation for N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide?
The canonical SMILES for N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide is Cc1cccc(C(=O)Nc2c(Br)cccc2Br)c1F.
What is the InChIKey of N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide?
The InChIKey is CSPGFYHZTPKJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Br2FNO/c1-8-4-2-5-9(12(8)17)14(19)18-13-10(15)6-3-7-11(13)16/h2-7H,1H3,(H,18,19).
What are the key properties of N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide?
N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide has a molecular weight of 387.05 g/mol, XLogP of 4.91, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dibromophenyl)-2-fluoro-3-methylbenzamide is sourced from PubChem (CID 107598701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).