4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide

C16H15FN2O2 — CID 18194975

IUPAC4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide
SMILESCC(=O)NCc1ccc(C(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C16H15FN2O2/c1-11(20)18-10-12-5-7-13(8-6-12)16(21)19-15-4-2-3-14(17)9-15/h2-9H,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyJOOQEDKQQBHWSK-UHFFFAOYSA-N
MW286.31 g/mol
LogP2.71
Rot. Bonds4

About 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide

4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide (PubChem CID 18194975) has the molecular formula C16H15FN2O2 and a molecular weight of 286.31 g/mol. Its IUPAC name is 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide.

Molecular Properties

Compound Name4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide
PubChem CID18194975
Molecular FormulaC16H15FN2O2
Molecular Weight286.31 g/mol
Exact Mass286.11
IUPAC Name4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide
SMILESCC(=O)NCc1ccc(C(=O)Nc2cccc(F)c2)cc1
InChIInChI=1S/C16H15FN2O2/c1-11(20)18-10-12-5-7-13(8-6-12)16(21)19-15-4-2-3-14(17)9-15/h2-9H,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyJOOQEDKQQBHWSK-UHFFFAOYSA-N
XLogP2.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[4-(acetamidomethyl)benzoyl]amino]benzamide
CID 78807046
4-[[(3-fluorophenyl)carbamoylamino]methyl]-N-methylbenzamide
CID 86986467
4-(acetamidomethyl)-N-[3-[(dimethylamino)methyl]phenyl]benzamide
CID 86931986
4-(acetamidomethyl)-N-(2,4-difluorophenyl)benzamide
CID 18195856
3-acetamido-N-(3-fluorophenyl)benzamide
CID 2443243
4-N-(3-acetamidophenyl)-1-N-benzylbenzene-1,4-dicarboxamide
CID 109046750
N-(3-fluorophenyl)-4-(methylamino)benzamide
CID 62166900
4-(acetamidomethyl)-N-(3,4-dichlorophenyl)benzamide
CID 18194972
4-(2-amino-2-sulfanylideneethyl)-N-(3-fluorophenyl)benzamide
CID 82179496
4-N-(3-fluorophenyl)-1-N-(4-methylphenyl)benzene-1,4-dicarboxamide
CID 109049444
methyl 4-[(3-fluorophenyl)carbamoyl]benzoate
CID 9412634
4-(acetamidomethyl)-N-(4-phenylphenyl)benzamide
CID 78805930

Frequently Asked Questions

What is the IUPAC name of 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide?
The IUPAC name of 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide (CID 18194975) is 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide.
What is the SMILES notation for 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide?
The canonical SMILES for 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide is CC(=O)NCc1ccc(C(=O)Nc2cccc(F)c2)cc1.
What is the InChIKey of 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide?
The InChIKey is JOOQEDKQQBHWSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O2/c1-11(20)18-10-12-5-7-13(8-6-12)16(21)19-15-4-2-3-14(17)9-15/h2-9H,10H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide?
4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide has a molecular weight of 286.31 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(acetamidomethyl)-N-(3-fluorophenyl)benzamide is sourced from PubChem (CID 18194975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).