2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide

C15H19F2NO3 — CID 102634779

IUPAC2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1OC(F)F)C1CCCCC1O
InChIInChI=1S/C15H19F2NO3/c1-18(11-7-3-4-8-12(11)19)14(20)10-6-2-5-9-13(10)21-15(16)17/h2,5-6,9,11-12,15,19H,3-4,7-8H2,1H3
InChIKeyBNQHLKMSIJBVDM-UHFFFAOYSA-N
MW299.32 g/mol
LogP2.66
Rot. Bonds4

About 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide

2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide (PubChem CID 102634779) has the molecular formula C15H19F2NO3 and a molecular weight of 299.32 g/mol. Its IUPAC name is 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide.

Molecular Properties

Compound Name2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide
PubChem CID102634779
Molecular FormulaC15H19F2NO3
Molecular Weight299.32 g/mol
Exact Mass299.13
IUPAC Name2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1OC(F)F)C1CCCCC1O
InChIInChI=1S/C15H19F2NO3/c1-18(11-7-3-4-8-12(11)19)14(20)10-6-2-5-9-13(10)21-15(16)17/h2,5-6,9,11-12,15,19H,3-4,7-8H2,1H3
InChIKeyBNQHLKMSIJBVDM-UHFFFAOYSA-N
XLogP2.66
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.32
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide 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

N-[(1R,2R)-2-hydroxycyclohexyl]-2-methoxy-N-methylbenzamide
CID 19916383
N-[(1R,2R)-2-hydroxycyclohexyl]-N-methyl-2-methylsulfanylbenzamide
CID 19798383
5-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
CID 102635118
N-cyclopropyl-2-(difluoromethoxy)-N-(2-hydroxyethyl)benzamide
CID 43576922
3-fluoro-2-hydrazinyl-N-(2-hydroxycyclohexyl)-N-methylbenzamide
CID 102636872
N-[(1S,2R)-2-hydroxycyclohexyl]-N-methyl-4-phenylbenzamide
CID 27245407
N-[(1R,2R)-2-hydroxycyclohexyl]-N,2-dimethyl-3-nitrobenzamide
CID 19061815
2-(difluoromethoxy)-N-[[4-(hydroxymethyl)oxan-4-yl]methyl]-N-methylbenzamide
CID 91791837
2,4-dichloro-N-[(1R,2R)-2-hydroxycyclohexyl]-N-methylbenzamide
CID 19061812
[2-(difluoromethoxy)phenyl]-(4-hydroxypiperidin-1-yl)methanone
CID 43391804
2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide
CID 102632488
(2R)-2-(4-fluorophenoxy)-N-[(1R,2R)-2-hydroxycyclohexyl]-N-methylpropanamide
CID 124536446

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide?
The IUPAC name of 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide (CID 102634779) is 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide.
What is the SMILES notation for 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide?
The canonical SMILES for 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide is CN(C(=O)c1ccccc1OC(F)F)C1CCCCC1O.
What is the InChIKey of 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide?
The InChIKey is BNQHLKMSIJBVDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F2NO3/c1-18(11-7-3-4-8-12(11)19)14(20)10-6-2-5-9-13(10)21-15(16)17/h2,5-6,9,11-12,15,19H,3-4,7-8H2,1H3.
What are the key properties of 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide?
2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide has a molecular weight of 299.32 g/mol, XLogP of 2.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethoxy)-N-(2-hydroxycyclohexyl)-N-methylbenzamide is sourced from PubChem (CID 102634779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).