4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide

C15H22N2O2 — CID 107074880

IUPAC4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide
SMILESCCC1CCC(NC(=O)c2ccc(N)c(O)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-2-10-3-6-12(7-4-10)17-15(19)11-5-8-13(16)14(18)9-11/h5,8-10,12,18H,2-4,6-7,16H2,1H3,(H,17,19)
InChIKeyUBNWJNOPEQPGCJ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.67
Rot. Bonds3

About 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide

4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide (PubChem CID 107074880) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide.

Molecular Properties

Compound Name4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide
PubChem CID107074880
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide
SMILESCCC1CCC(NC(=O)c2ccc(N)c(O)c2)CC1
InChIInChI=1S/C15H22N2O2/c1-2-10-3-6-12(7-4-10)17-15(19)11-5-8-13(16)14(18)9-11/h5,8-10,12,18H,2-4,6-7,16H2,1H3,(H,17,19)
InChIKeyUBNWJNOPEQPGCJ-UHFFFAOYSA-N
XLogP2.67
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-amino-N-[(4-ethylcyclohexyl)methyl]-3-hydroxybenzamide
CID 107074297
3-amino-4-(dimethylamino)-N-(4-ethylcyclohexyl)benzamide
CID 61466151
4-amino-3-hydroxy-N-(1-methylpiperidin-4-yl)benzamide
CID 89070568
4-amino-3-hydroxy-N-(1-methylpyrrolidin-3-yl)benzamide
CID 107074871
N-(4-aminocyclohexyl)-3-hydroxy-4-methylbenzamide
CID 43653129
N-(4-ethylcyclohexyl)-4-(methylamino)benzamide
CID 62179103
N-(4-ethylcyclohexyl)-2,3-dihydro-1H-indole-5-carboxamide
CID 61470340
4-amino-3-[(4-ethylcyclohexyl)amino]-N-methylbenzamide
CID 63357473
N-(4-ethylcyclohexyl)-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CID 112816440
5-amino-N-(4-ethylcyclohexyl)-2-methylbenzamide
CID 61466325
N-(4-ethylcyclohexyl)-5-sulfamoylthiophene-3-carboxamide
CID 61244512
2-amino-N-(4-ethylcyclohexyl)-4-fluorobenzamide
CID 63110662

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide?
The IUPAC name of 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide (CID 107074880) is 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide.
What is the SMILES notation for 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide?
The canonical SMILES for 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide is CCC1CCC(NC(=O)c2ccc(N)c(O)c2)CC1.
What is the InChIKey of 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide?
The InChIKey is UBNWJNOPEQPGCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-10-3-6-12(7-4-10)17-15(19)11-5-8-13(16)14(18)9-11/h5,8-10,12,18H,2-4,6-7,16H2,1H3,(H,17,19).
What are the key properties of 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide?
4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide has a molecular weight of 262.35 g/mol, XLogP of 2.67, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-ethylcyclohexyl)-3-hydroxybenzamide is sourced from PubChem (CID 107074880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).