N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide

C15H21NO3 — CID 107723193

IUPACN-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide
SMILESCC1CC(C)CC(NC(=O)c2cc(O)ccc2O)C1
InChIInChI=1S/C15H21NO3/c1-9-5-10(2)7-11(6-9)16-15(19)13-8-12(17)3-4-14(13)18/h3-4,8-11,17-18H,5-7H2,1-2H3,(H,16,19)
InChIKeyXJUODGYXNTWEEZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.65
Rot. Bonds2

About N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide

N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide (PubChem CID 107723193) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide
PubChem CID107723193
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide
SMILESCC1CC(C)CC(NC(=O)c2cc(O)ccc2O)C1
InChIInChI=1S/C15H21NO3/c1-9-5-10(2)7-11(6-9)16-15(19)13-8-12(17)3-4-14(13)18/h3-4,8-11,17-18H,5-7H2,1-2H3,(H,16,19)
InChIKeyXJUODGYXNTWEEZ-UHFFFAOYSA-N
XLogP2.65
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

2,5-dihydroxy-N-(3-methylcyclopentyl)benzamide
CID 107723891
2-amino-5-hydroxy-N-(3-methylcyclobutyl)benzamide
CID 107076024
2,5-dihydroxy-N-(6-methylpiperidin-3-yl)benzamide
CID 107721922
2-hydroxy-4-methoxy-N-(3-methylcyclobutyl)benzamide
CID 115671067
2,5-dihydroxy-N-(2-methyloxan-4-yl)benzamide
CID 114108164
2,4-dihydroxy-N-(3-methylcyclohexyl)benzamide
CID 103612467
N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide
CID 107723198
2,5-dihydroxy-N-(4-propylcyclohexyl)benzamide
CID 107722644
2,5-dihydroxy-N-(thian-3-yl)benzamide
CID 107723796
N-(3,5-dimethylcyclohexyl)-2-fluorobenzamide
CID 64724976
2-amino-N-(3,5-dimethylcyclohexyl)-4-methoxybenzamide
CID 115413365
2,5-dihydroxy-N-(2-methoxycyclopentyl)benzamide
CID 107722870

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide (CID 107723193) is N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide is CC1CC(C)CC(NC(=O)c2cc(O)ccc2O)C1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide?
The InChIKey is XJUODGYXNTWEEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-9-5-10(2)7-11(6-9)16-15(19)13-8-12(17)3-4-14(13)18/h3-4,8-11,17-18H,5-7H2,1-2H3,(H,16,19).
What are the key properties of N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide?
N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide has a molecular weight of 263.34 g/mol, XLogP of 2.65, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide is sourced from PubChem (CID 107723193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).