5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide

C10H11F2NO3 — CID 173469692

IUPAC5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide
SMILESNC(=O)c1cc(OC(F)F)ccc1CCO
InChIInChI=1S/C10H11F2NO3/c11-10(12)16-7-2-1-6(3-4-14)8(5-7)9(13)15/h1-2,5,10,14H,3-4H2,(H2,13,15)
InChIKeyWPVRHNWQOWIWLD-UHFFFAOYSA-N
MW231.20 g/mol
LogP0.92
Rot. Bonds5

About 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide

5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide (PubChem CID 173469692) has the molecular formula C10H11F2NO3 and a molecular weight of 231.20 g/mol. Its IUPAC name is 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide
PubChem CID173469692
Molecular FormulaC10H11F2NO3
Molecular Weight231.20 g/mol
Exact Mass231.07
IUPAC Name5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide
SMILESNC(=O)c1cc(OC(F)F)ccc1CCO
InChIInChI=1S/C10H11F2NO3/c11-10(12)16-7-2-1-6(3-4-14)8(5-7)9(13)15/h1-2,5,10,14H,3-4H2,(H2,13,15)
InChIKeyWPVRHNWQOWIWLD-UHFFFAOYSA-N
XLogP0.92
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.20
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(difluoromethoxy)-2-hydroxybenzamide
CID 141002128
ethyl 2-(3-bromopropyl)-5-(difluoromethoxy)benzoate
CID 134643956
2-[4-(difluoromethoxy)phenyl]ethanol;ethane
CID 142357995
3-fluoro-4-(2-hydroxyethyl)benzamide
CID 175907153
2-[[2,4-bis(difluoromethoxy)phenyl]methylamino]propanamide
CID 43402355
3-bromo-1-[2-(chloromethyl)-5-(difluoromethoxy)phenyl]propan-1-one
CID 134624329
methyl 3-[4-(difluoromethoxy)-2-hydroxyphenyl]propanoate
CID 134634678
methyl 5-(difluoromethoxy)-2-hydrazinylbenzoate
CID 134649425
1-[5-(difluoromethoxy)-2-methoxyphenyl]propan-1-one
CID 134628763
3-[4-(difluoromethoxy)-2-fluorophenyl]propanal
CID 134621994
4-(difluoromethoxy)-2-(3-oxopropyl)benzoic acid
CID 118817498
3-[4-(difluoromethoxy)-2-ethylphenyl]propanenitrile
CID 118818436

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide?
The IUPAC name of 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide (CID 173469692) is 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide?
The canonical SMILES for 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide is NC(=O)c1cc(OC(F)F)ccc1CCO.
What is the InChIKey of 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide?
The InChIKey is WPVRHNWQOWIWLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO3/c11-10(12)16-7-2-1-6(3-4-14)8(5-7)9(13)15/h1-2,5,10,14H,3-4H2,(H2,13,15).
What are the key properties of 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide?
5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide has a molecular weight of 231.20 g/mol, XLogP of 0.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)-2-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 173469692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).