3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide

C16H15F2NO — CID 4785745

IUPAC3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1
InChIInChI=1S/C16H15F2NO/c1-10(2)11-3-5-15(6-4-11)19-16(20)12-7-13(17)9-14(18)8-12/h3-10H,1-2H3,(H,19,20)
InChIKeyACNHJLMPMJVICQ-UHFFFAOYSA-N
MW275.30 g/mol
LogP4.34
Rot. Bonds3

About 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide

3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide (PubChem CID 4785745) has the molecular formula C16H15F2NO and a molecular weight of 275.30 g/mol. Its IUPAC name is 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide
PubChem CID4785745
Molecular FormulaC16H15F2NO
Molecular Weight275.30 g/mol
Exact Mass275.11
IUPAC Name3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1
InChIInChI=1S/C16H15F2NO/c1-10(2)11-3-5-15(6-4-11)19-16(20)12-7-13(17)9-14(18)8-12/h3-10H,1-2H3,(H,19,20)
InChIKeyACNHJLMPMJVICQ-UHFFFAOYSA-N
XLogP4.34
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.30
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,3-N,5-N-tris(4-propan-2-ylphenyl)benzene-1,3,5-tricarboxamide
CID 67992142
4-propan-2-yl-N-(4-propan-2-ylphenyl)benzamide
CID 1406437
3,5-difluoro-N-(4-methylphenyl)benzamide
CID 2111363
4-N-(3-fluorophenyl)-1-N-(4-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109049826
3-chloro-4-fluoro-N-(4-propan-2-ylphenyl)benzamide
CID 121261386
3,5-difluoro-N-(4-iodophenyl)benzamide
CID 3874548
N-(4-aminophenyl)-3-fluoro-5-methylbenzamide
CID 113265229
[3-acetyloxy-5-[(4-propan-2-ylphenyl)carbamoyl]phenyl] acetate
CID 2975179
3-fluoro-N-(4-hydroxyphenyl)-5-methylbenzamide
CID 113246156
N-(4-propan-2-ylphenyl)pyrimidine-5-carboxamide
CID 110466850
3-iodo-N-(4-propan-2-ylphenyl)benzamide
CID 1154174
N-(4-ethoxyphenyl)-3,5-difluorobenzamide
CID 8745463

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide?
The IUPAC name of 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide (CID 4785745) is 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide?
The canonical SMILES for 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide is CC(C)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1.
What is the InChIKey of 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide?
The InChIKey is ACNHJLMPMJVICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F2NO/c1-10(2)11-3-5-15(6-4-11)19-16(20)12-7-13(17)9-14(18)8-12/h3-10H,1-2H3,(H,19,20).
What are the key properties of 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide?
3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide has a molecular weight of 275.30 g/mol, XLogP of 4.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 4785745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).