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

C15H21NO3 — CID 107723198

IUPACN-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide
SMILESCCC1CCCC(NC(=O)c2cc(O)ccc2O)C1
InChIInChI=1S/C15H21NO3/c1-2-10-4-3-5-11(8-10)16-15(19)13-9-12(17)6-7-14(13)18/h6-7,9-11,17-18H,2-5,8H2,1H3,(H,16,19)
InChIKeySMCGZBBQUQRLTD-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.80
Rot. Bonds3

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

N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide (PubChem CID 107723198) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide.

Molecular Properties

Compound NameN-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide
PubChem CID107723198
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide
SMILESCCC1CCCC(NC(=O)c2cc(O)ccc2O)C1
InChIInChI=1S/C15H21NO3/c1-2-10-4-3-5-11(8-10)16-15(19)13-9-12(17)6-7-14(13)18/h6-7,9-11,17-18H,2-5,8H2,1H3,(H,16,19)
InChIKeySMCGZBBQUQRLTD-UHFFFAOYSA-N
XLogP2.80
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.80
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
2,5-dihydroxy-N-(4-propylcyclohexyl)benzamide
CID 107722644
2-amino-N-(3-ethylcyclohexyl)benzamide
CID 64743131
2-amino-N-(3-ethylcyclohexyl)-5-methoxybenzamide
CID 64749007
N-(3-ethylcyclohexyl)-2-hydrazinylbenzamide
CID 64750344
5-amino-N-(3-ethylcyclohexyl)-2-fluorobenzamide
CID 64748209
2-amino-4-chloro-N-(3-ethylcyclohexyl)benzamide
CID 64743130
N-(3-ethylcyclohexyl)-2-fluoro-5-sulfanylbenzamide
CID 107031015
N-(3,5-dimethylcyclohexyl)-2,5-dihydroxybenzamide
CID 107723193
2,5-dihydroxy-N-(2-methyloxan-4-yl)benzamide
CID 114108164
4-bromo-N-(3-ethylcyclohexyl)-2-methoxybenzamide
CID 115369289
2,5-dihydroxy-N-(thian-3-yl)benzamide
CID 107723796

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide?
The IUPAC name of N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide (CID 107723198) is N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide.
What is the SMILES notation for N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide?
The canonical SMILES for N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide is CCC1CCCC(NC(=O)c2cc(O)ccc2O)C1.
What is the InChIKey of N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide?
The InChIKey is SMCGZBBQUQRLTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-2-10-4-3-5-11(8-10)16-15(19)13-9-12(17)6-7-14(13)18/h6-7,9-11,17-18H,2-5,8H2,1H3,(H,16,19).
What are the key properties of N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide?
N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide has a molecular weight of 263.34 g/mol, XLogP of 2.80, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylcyclohexyl)-2,5-dihydroxybenzamide is sourced from PubChem (CID 107723198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).