2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide

C15H21NO3 — CID 102632488

IUPAC2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide
SMILESCc1ccc(O)c(C(=O)N(C)C2CCCCC2O)c1
InChIInChI=1S/C15H21NO3/c1-10-7-8-13(17)11(9-10)15(19)16(2)12-5-3-4-6-14(12)18/h7-9,12,14,17-18H,3-6H2,1-2H3
InChIKeyROLIEWAPWNHZOT-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.08
Rot. Bonds2

About 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide

2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide (PubChem CID 102632488) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide.

Molecular Properties

Compound Name2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide
PubChem CID102632488
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide
SMILESCc1ccc(O)c(C(=O)N(C)C2CCCCC2O)c1
InChIInChI=1S/C15H21NO3/c1-10-7-8-13(17)11(9-10)15(19)16(2)12-5-3-4-6-14(12)18/h7-9,12,14,17-18H,3-6H2,1-2H3
InChIKeyROLIEWAPWNHZOT-UHFFFAOYSA-N
XLogP2.08
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2-hydroxy-N,5-dimethylbenzamide
CID 43409240
2-hydrazinyl-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide
CID 102636877
4-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
CID 102631843
5-fluoro-N-(2-hydroxycyclohexyl)-N,2-dimethylbenzamide
CID 102635118
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-hydroxy-N,5-dimethylbenzamide
CID 61233345
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methoxy-N-methylbenzamide
CID 19916383
2,4-dichloro-N-[(1R,2R)-2-hydroxycyclohexyl]-N-methylbenzamide
CID 19061812
2-chloro-N-(2-hydroxycyclohexyl)-N-methyl-5-sulfanylbenzamide
CID 107036632
N-(2-hydroxycyclohexyl)-N-methyl-3-(4-methylphenyl)propanamide
CID 102635327
N-[(1R,2R)-2-hydroxycyclohexyl]-N-methyl-2-methylsulfanylbenzamide
CID 19798383
2-hydroxy-N,5-dimethyl-N-(oxan-2-ylmethyl)benzamide
CID 47344741
5-amino-2-fluoro-N-(2-hydroxycyclohexyl)-N,3-dimethylbenzamide
CID 103296931

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide?
The IUPAC name of 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide (CID 102632488) is 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide.
What is the SMILES notation for 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide?
The canonical SMILES for 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide is Cc1ccc(O)c(C(=O)N(C)C2CCCCC2O)c1.
What is the InChIKey of 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide?
The InChIKey is ROLIEWAPWNHZOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-10-7-8-13(17)11(9-10)15(19)16(2)12-5-3-4-6-14(12)18/h7-9,12,14,17-18H,3-6H2,1-2H3.
What are the key properties of 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide?
2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide has a molecular weight of 263.34 g/mol, XLogP of 2.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(2-hydroxycyclohexyl)-N,5-dimethylbenzamide is sourced from PubChem (CID 102632488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).