3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide

C14H11F2NO3 — CID 118446648

IUPAC3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide
SMILESNC(=O)c1cccc(-c2cc(O)ccc2OC(F)F)c1
InChIInChI=1S/C14H11F2NO3/c15-14(16)20-12-5-4-10(18)7-11(12)8-2-1-3-9(6-8)13(17)19/h1-7,14,18H,(H2,17,19)
InChIKeyHCPIBPMBXDOYDC-UHFFFAOYSA-N
MW279.24 g/mol
LogP2.76
Rot. Bonds4

About 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide

3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide (PubChem CID 118446648) has the molecular formula C14H11F2NO3 and a molecular weight of 279.24 g/mol. Its IUPAC name is 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide.

Molecular Properties

Compound Name3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide
PubChem CID118446648
Molecular FormulaC14H11F2NO3
Molecular Weight279.24 g/mol
Exact Mass279.07
IUPAC Name3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide
SMILESNC(=O)c1cccc(-c2cc(O)ccc2OC(F)F)c1
InChIInChI=1S/C14H11F2NO3/c15-14(16)20-12-5-4-10(18)7-11(12)8-2-1-3-9(6-8)13(17)19/h1-7,14,18H,(H2,17,19)
InChIKeyHCPIBPMBXDOYDC-UHFFFAOYSA-N
XLogP2.76
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.24
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(difluoromethoxy)-5-methylphenyl]benzamide
CID 126731000
4-(difluoromethoxy)-3-fluorobenzamide
CID 90825397
3-(difluoromethoxy)-4-methoxybenzamide
CID 47245743
[3-(3-chlorophenyl)-4-(difluoromethoxy)phenyl]methyl hydrogen carbonate
CID 141248603
3-(2,3,4-trimethoxyphenyl)benzamide
CID 174562773
3-[5-butoxy-2-(difluoromethoxy)phenyl]-N-methylbenzamide
CID 118446897
3-(3-fluoro-4-methoxyphenyl)benzamide
CID 68818750
3-[[3-chloro-4-(difluoromethoxy)phenyl]methylamino]benzamide
CID 71913606
3-[4-[1-(dimethylamino)-1-oxopropan-2-yl]oxynaphthalen-1-yl]benzamide
CID 172670829
4-methoxy-3-(3-methoxyphenyl)benzamide
CID 123866555
3-[[[N-[[2-(difluoromethoxy)phenyl]methyl]-N'-methylcarbamimidoyl]amino]methyl]benzamide
CID 111865562
3-[2-(difluoromethoxy)-5-methylphenyl]benzenesulfonamide
CID 126731002

Frequently Asked Questions

What is the IUPAC name of 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide?
The IUPAC name of 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide (CID 118446648) is 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide.
What is the SMILES notation for 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide?
The canonical SMILES for 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide is NC(=O)c1cccc(-c2cc(O)ccc2OC(F)F)c1.
What is the InChIKey of 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide?
The InChIKey is HCPIBPMBXDOYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2NO3/c15-14(16)20-12-5-4-10(18)7-11(12)8-2-1-3-9(6-8)13(17)19/h1-7,14,18H,(H2,17,19).
What are the key properties of 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide?
3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide has a molecular weight of 279.24 g/mol, XLogP of 2.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(difluoromethoxy)-5-hydroxyphenyl]benzamide is sourced from PubChem (CID 118446648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).