3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide

C15H19NO2 — CID 87551117

IUPAC3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide
SMILESNC(=O)c1cccc(C2CC3CCC(C3)C2)c1O
InChIInChI=1S/C15H19NO2/c16-15(18)13-3-1-2-12(14(13)17)11-7-9-4-5-10(6-9)8-11/h1-3,9-11,17H,4-8H2,(H2,16,18)
InChIKeyLRIDZVYCBPVUBB-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.78
Rot. Bonds2

About 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide

3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide (PubChem CID 87551117) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide
PubChem CID87551117
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide
SMILESNC(=O)c1cccc(C2CC3CCC(C3)C2)c1O
InChIInChI=1S/C15H19NO2/c16-15(18)13-3-1-2-12(14(13)17)11-7-9-4-5-10(6-9)8-11/h1-3,9-11,17H,4-8H2,(H2,16,18)
InChIKeyLRIDZVYCBPVUBB-UHFFFAOYSA-N
XLogP2.78
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-hydroxy-3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)benzamide
CID 143770547
2-hydroxybenzene-1,3-dicarboxamide
CID 22594874
3-[8-(3-benzamidopropyl)-8-azabicyclo[3.2.1]octan-3-yl]-2-hydroxybenzamide
CID 67152075
2-(3,5-diaminocyclohexyl)benzamide
CID 68506787
2-[(3aS,6aR)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-5-yl]benzamide
CID 175757308
3-cyclohexyl-2-fluorobenzamide
CID 142776335
2-(1-adamantyl)-3-hydroxybenzene-1,4-dicarboxamide
CID 141262153
2-(8-azabicyclo[3.2.1]octan-3-yl)benzamide;hydrochloride
CID 68749211
2-(3-sulfanylcyclohexyl)benzamide
CID 166057237
3-[(1R,5R)-8-[2-[(4,4-difluorocyclohexyl)methyl-(2-hydroxyacetyl)amino]ethyl]-8-azabicyclo[3.2.1]octan-3-yl]-2-hydroxybenzamide
CID 25211083
2,6-di(cyclobutyl)phenol
CID 57426118
(1R)-1-amino-2,3-dihydro-1H-indene-4-carboxamide
CID 130682508

Frequently Asked Questions

What is the IUPAC name of 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide?
The IUPAC name of 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide (CID 87551117) is 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide.
What is the SMILES notation for 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide?
The canonical SMILES for 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide is NC(=O)c1cccc(C2CC3CCC(C3)C2)c1O.
What is the InChIKey of 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide?
The InChIKey is LRIDZVYCBPVUBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c16-15(18)13-3-1-2-12(14(13)17)11-7-9-4-5-10(6-9)8-11/h1-3,9-11,17H,4-8H2,(H2,16,18).
What are the key properties of 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide?
3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide has a molecular weight of 245.32 g/mol, XLogP of 2.78, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-bicyclo[3.2.1]octanyl)-2-hydroxybenzamide is sourced from PubChem (CID 87551117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).