3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide

C15H22N2O2 — CID 91584143

IUPAC3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide
SMILESNc1cc(C(=O)NCCC2CCCCC2)ccc1O
InChIInChI=1S/C15H22N2O2/c16-13-10-12(6-7-14(13)18)15(19)17-9-8-11-4-2-1-3-5-11/h6-7,10-11,18H,1-5,8-9,16H2,(H,17,19)
InChIKeyLPLFQUMREQFQFU-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.67
Rot. Bonds4

About 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide

3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide (PubChem CID 91584143) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide.

Molecular Properties

Compound Name3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide
PubChem CID91584143
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide
SMILESNc1cc(C(=O)NCCC2CCCCC2)ccc1O
InChIInChI=1S/C15H22N2O2/c16-13-10-12(6-7-14(13)18)15(19)17-9-8-11-4-2-1-3-5-11/h6-7,10-11,18H,1-5,8-9,16H2,(H,17,19)
InChIKeyLPLFQUMREQFQFU-UHFFFAOYSA-N
XLogP2.67
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
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-(2-cyclohexylethyl)-3-fluorobenzamide
CID 62680038
N-(2-cyclopentylethyl)-3-hydroxy-4-methylbenzamide
CID 54932367
3-amino-N-(2-cyclopentylethyl)-4-(dimethylamino)benzamide
CID 61102345
3-amino-N-(2-cyclopentylethyl)-4-methoxybenzamide
CID 54932498
4-amino-N-(2-cyclohexylethyl)-3-methoxybenzamide
CID 104782492
3,5-diamino-N-(2-cyclohexylethyl)benzamide
CID 61103497
2-amino-N-(2-cyclopentylethyl)pyridine-4-carboxamide
CID 62161813
4-bromo-N-(2-cyclohexylethyl)benzamide
CID 63524562
3-chloro-N-(2-cyclohexylethyl)-4-iodobenzamide
CID 103221269
3-bromo-N-(2-cyclohexylethyl)-4-fluorobenzamide
CID 107951613
3-amino-N-(cyclohexylmethyl)-4-methylbenzamide
CID 43371353
N-(2-cyclohexylethyl)-4-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 60916634

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide?
The IUPAC name of 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide (CID 91584143) is 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide.
What is the SMILES notation for 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide?
The canonical SMILES for 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide is Nc1cc(C(=O)NCCC2CCCCC2)ccc1O.
What is the InChIKey of 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide?
The InChIKey is LPLFQUMREQFQFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c16-13-10-12(6-7-14(13)18)15(19)17-9-8-11-4-2-1-3-5-11/h6-7,10-11,18H,1-5,8-9,16H2,(H,17,19).
What are the key properties of 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide?
3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide has a molecular weight of 262.35 g/mol, XLogP of 2.67, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-cyclohexylethyl)-4-hydroxybenzamide is sourced from PubChem (CID 91584143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).