2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide

C11H13F2NO4 — CID 65309961

IUPAC2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide
SMILESO=C(NC(CO)CO)c1ccccc1OC(F)F
InChIInChI=1S/C11H13F2NO4/c12-11(13)18-9-4-2-1-3-8(9)10(17)14-7(5-15)6-16/h1-4,7,11,15-16H,5-6H2,(H,14,17)
InChIKeyGSYBAJRTBFFNRJ-UHFFFAOYSA-N
MW261.22 g/mol
LogP0.37
Rot. Bonds6

About 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide

2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide (PubChem CID 65309961) has the molecular formula C11H13F2NO4 and a molecular weight of 261.22 g/mol. Its IUPAC name is 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide.

Molecular Properties

Compound Name2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide
PubChem CID65309961
Molecular FormulaC11H13F2NO4
Molecular Weight261.22 g/mol
Exact Mass261.08
IUPAC Name2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide
SMILESO=C(NC(CO)CO)c1ccccc1OC(F)F
InChIInChI=1S/C11H13F2NO4/c12-11(13)18-9-4-2-1-3-8(9)10(17)14-7(5-15)6-16/h1-4,7,11,15-16H,5-6H2,(H,14,17)
InChIKeyGSYBAJRTBFFNRJ-UHFFFAOYSA-N
XLogP0.37
TPSA78.79 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.22
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(difluoromethoxy)-N-(1-hydroxypropan-2-yl)benzamide
CID 43418621
N-(1-amino-3-methoxypropan-2-yl)-2-(difluoromethoxy)benzamide
CID 106180569
2-(difluoromethoxy)-N-ethylbenzamide
CID 60644731
2-(difluoromethoxy)-N-(3-oxopentan-2-yl)benzamide
CID 64991633
N-[(2S)-1-amino-1-oxopropan-2-yl]-2-(difluoromethoxy)benzamide
CID 95577209
2-(difluoromethoxy)-N-methylbenzamide;ethane
CID 155585824
N-(1-chloro-3-methylbutan-2-yl)-2-(difluoromethoxy)benzamide
CID 113273535
N-(1-cyanoethyl)-2-(difluoromethoxy)benzamide
CID 61121836
N-benzyl-2-(difluoromethoxy)benzamide
CID 40548463
2-(difluoromethoxy)-N-propylbenzamide
CID 60654909
2-(difluoromethoxy)-N-(6-hydroxyhexyl)benzamide
CID 103918835
N-(3,3-difluoro-2-hydroxypropyl)-2-(difluoromethoxy)benzamide
CID 103770487

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide?
The IUPAC name of 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide (CID 65309961) is 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide.
What is the SMILES notation for 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide?
The canonical SMILES for 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide is O=C(NC(CO)CO)c1ccccc1OC(F)F.
What is the InChIKey of 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide?
The InChIKey is GSYBAJRTBFFNRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F2NO4/c12-11(13)18-9-4-2-1-3-8(9)10(17)14-7(5-15)6-16/h1-4,7,11,15-16H,5-6H2,(H,14,17).
What are the key properties of 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide?
2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide has a molecular weight of 261.22 g/mol, XLogP of 0.37, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-N-(1,3-dihydroxypropan-2-yl)benzamide is sourced from PubChem (CID 65309961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).