4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide

C16H17FN2O — CID 78769182

IUPAC4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
SMILESCc1ccc(F)c(NC(=O)c2ccc(N(C)C)cc2)c1
InChIInChI=1S/C16H17FN2O/c1-11-4-9-14(17)15(10-11)18-16(20)12-5-7-13(8-6-12)19(2)3/h4-10H,1-3H3,(H,18,20)
InChIKeyDEBGSMLNUFXZCY-UHFFFAOYSA-N
MW272.32 g/mol
LogP3.45
Rot. Bonds3

About 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide

4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide (PubChem CID 78769182) has the molecular formula C16H17FN2O and a molecular weight of 272.32 g/mol. Its IUPAC name is 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide.

Molecular Properties

Compound Name4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
PubChem CID78769182
Molecular FormulaC16H17FN2O
Molecular Weight272.32 g/mol
Exact Mass272.13
IUPAC Name4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
SMILESCc1ccc(F)c(NC(=O)c2ccc(N(C)C)cc2)c1
InChIInChI=1S/C16H17FN2O/c1-11-4-9-14(17)15(10-11)18-16(20)12-5-7-13(8-6-12)19(2)3/h4-10H,1-3H3,(H,18,20)
InChIKeyDEBGSMLNUFXZCY-UHFFFAOYSA-N
XLogP3.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.32
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluoro-5-methylphenyl)-4-methylbenzamide
CID 7718843
4-(chloromethyl)-N-(2-fluoro-5-methylphenyl)benzamide
CID 43333534
N-(2-fluoro-5-methylphenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 28825950
N-(2-fluoro-5-methylphenyl)-3-hydroxy-4-methylbenzamide
CID 28881843
4-(1,3-dithiolan-2-yl)-N-(2-fluoro-5-methylphenyl)benzamide
CID 26881926
3-[(2-fluoro-5-methylphenyl)carbamoyl]benzoic acid
CID 43452946
3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26522946
N-(2-fluoro-5-methylphenyl)-5-iodothiophene-3-carboxamide
CID 78948686
4-fluoro-N-(2-fluoro-5-methylphenyl)-2-methylbenzamide
CID 112702327
3-[[4-(dimethylamino)benzoyl]amino]-4-methylbenzoic acid
CID 24695586
4-(dimethylamino)-N-[2-(4-methylanilino)phenyl]benzamide
CID 108745006
3-bromo-5-chloro-N-(2-fluoro-5-methylphenyl)benzamide
CID 107951534

Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
The IUPAC name of 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide (CID 78769182) is 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide.
What is the SMILES notation for 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
The canonical SMILES for 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide is Cc1ccc(F)c(NC(=O)c2ccc(N(C)C)cc2)c1.
What is the InChIKey of 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
The InChIKey is DEBGSMLNUFXZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O/c1-11-4-9-14(17)15(10-11)18-16(20)12-5-7-13(8-6-12)19(2)3/h4-10H,1-3H3,(H,18,20).
What are the key properties of 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide has a molecular weight of 272.32 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)-N-(2-fluoro-5-methylphenyl)benzamide is sourced from PubChem (CID 78769182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).