4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide

C15H20ClNO2 — CID 63999982

IUPAC4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide
SMILESCC1CCC(NC(=O)c2ccc(Cl)cc2O)C(C)C1
InChIInChI=1S/C15H20ClNO2/c1-9-3-6-13(10(2)7-9)17-15(19)12-5-4-11(16)8-14(12)18/h4-5,8-10,13,18H,3,6-7H2,1-2H3,(H,17,19)
InChIKeySGNLKFYETJNIBN-UHFFFAOYSA-N
MW281.78 g/mol
LogP3.60
Rot. Bonds2

About 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide

4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide (PubChem CID 63999982) has the molecular formula C15H20ClNO2 and a molecular weight of 281.78 g/mol. Its IUPAC name is 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide
PubChem CID63999982
Molecular FormulaC15H20ClNO2
Molecular Weight281.78 g/mol
Exact Mass281.12
IUPAC Name4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide
SMILESCC1CCC(NC(=O)c2ccc(Cl)cc2O)C(C)C1
InChIInChI=1S/C15H20ClNO2/c1-9-3-6-13(10(2)7-9)17-15(19)12-5-4-11(16)8-14(12)18/h4-5,8-10,13,18H,3,6-7H2,1-2H3,(H,17,19)
InChIKeySGNLKFYETJNIBN-UHFFFAOYSA-N
XLogP3.60
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.78
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-2-chloro-N-(2,4-dimethylcyclohexyl)benzamide
CID 63998181
5-bromo-N-(2,4-dimethylcyclohexyl)-2-fluorobenzamide
CID 63996958
4-chloro-2-hydroxy-N-[(1S,2S)-2-hydroxycyclohexyl]benzamide
CID 94413889
2-chloro-N-(2,4-dimethylcyclohexyl)furan-3-carboxamide
CID 106686861
4-chloro-N-(2-chlorocyclohexyl)-2-hydroxybenzamide
CID 113272580
N-(2,4-dimethylcyclohexyl)-2-methyl-5-sulfanylbenzamide
CID 107030364
N-(2,4-dimethylcyclohexyl)-4-fluoro-2-methylbenzamide
CID 113268698
3-[(4-chloro-2-hydroxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 66031335
4-chloro-2-hydroxy-N-piperidin-4-ylbenzamide
CID 43345705
4-chloro-2-hydroxy-N-pyrrolidin-3-ylbenzamide
CID 62378983
4-chloro-2-hydroxy-N-[2-(N'-hydroxycarbamimidoyl)cyclopentyl]benzamide
CID 76978486
2-amino-4-chloro-N-(2-methylcyclopropyl)benzamide
CID 62398884

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide?
The IUPAC name of 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide (CID 63999982) is 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide.
What is the SMILES notation for 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide?
The canonical SMILES for 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide is CC1CCC(NC(=O)c2ccc(Cl)cc2O)C(C)C1.
What is the InChIKey of 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide?
The InChIKey is SGNLKFYETJNIBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO2/c1-9-3-6-13(10(2)7-9)17-15(19)12-5-4-11(16)8-14(12)18/h4-5,8-10,13,18H,3,6-7H2,1-2H3,(H,17,19).
What are the key properties of 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide?
4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide has a molecular weight of 281.78 g/mol, XLogP of 3.60, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2,4-dimethylcyclohexyl)-2-hydroxybenzamide is sourced from PubChem (CID 63999982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).