2-fluoro-5-methyl-4-phenylbenzamide

C14H12FNO — CID 171905692

IUPAC2-fluoro-5-methyl-4-phenylbenzamide
SMILESCc1cc(C(N)=O)c(F)cc1-c1ccccc1
InChIInChI=1S/C14H12FNO/c1-9-7-12(14(16)17)13(15)8-11(9)10-5-3-2-4-6-10/h2-8H,1H3,(H2,16,17)
InChIKeyKMKWRXUTBCPRCN-UHFFFAOYSA-N
MW229.25 g/mol
LogP2.90
Rot. Bonds2

About 2-fluoro-5-methyl-4-phenylbenzamide

2-fluoro-5-methyl-4-phenylbenzamide (PubChem CID 171905692) has the molecular formula C14H12FNO and a molecular weight of 229.25 g/mol. Its IUPAC name is 2-fluoro-5-methyl-4-phenylbenzamide.

Molecular Properties

Compound Name2-fluoro-5-methyl-4-phenylbenzamide
PubChem CID171905692
Molecular FormulaC14H12FNO
Molecular Weight229.25 g/mol
Exact Mass229.09
IUPAC Name2-fluoro-5-methyl-4-phenylbenzamide
SMILESCc1cc(C(N)=O)c(F)cc1-c1ccccc1
InChIInChI=1S/C14H12FNO/c1-9-7-12(14(16)17)13(15)8-11(9)10-5-3-2-4-6-10/h2-8H,1H3,(H2,16,17)
InChIKeyKMKWRXUTBCPRCN-UHFFFAOYSA-N
XLogP2.90
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,5-dimethyl-4-phenylbenzamide
CID 174491618
ethane;2-fluoro-4-phenylbenzamide;molecular hydrogen
CID 143768800
carbamic acid;3-methyl-4-phenylaniline
CID 175552466
(2-amino-5-methyl-4-phenylphenyl)-(2-chlorophenyl)methanone
CID 143211334
3-amino-4,5-dimethyl-2-phenylbenzamide
CID 87844639
2,3-dichloro-4-fluoro-6-phenylbenzamide
CID 118433439
4-fluoro-2,5-dimethylbenzamide
CID 119025196
2-fluoro-4-(2-fluorophenyl)benzamide
CID 46312270
4-(2-carbamoylphenyl)-2-fluorobenzoic acid
CID 150992694
2-methyl-3-phenylbenzamide;2,2,2-trifluoroacetic acid
CID 67159928
methyl 2-amino-4-methyl-5-phenylbenzoate
CID 113445321
4-fluoro-5-phenylpyridine-3-carboxamide
CID 91379207

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methyl-4-phenylbenzamide?
The IUPAC name of 2-fluoro-5-methyl-4-phenylbenzamide (CID 171905692) is 2-fluoro-5-methyl-4-phenylbenzamide.
What is the SMILES notation for 2-fluoro-5-methyl-4-phenylbenzamide?
The canonical SMILES for 2-fluoro-5-methyl-4-phenylbenzamide is Cc1cc(C(N)=O)c(F)cc1-c1ccccc1.
What is the InChIKey of 2-fluoro-5-methyl-4-phenylbenzamide?
The InChIKey is KMKWRXUTBCPRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FNO/c1-9-7-12(14(16)17)13(15)8-11(9)10-5-3-2-4-6-10/h2-8H,1H3,(H2,16,17).
What are the key properties of 2-fluoro-5-methyl-4-phenylbenzamide?
2-fluoro-5-methyl-4-phenylbenzamide has a molecular weight of 229.25 g/mol, XLogP of 2.90, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methyl-4-phenylbenzamide is sourced from PubChem (CID 171905692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).