N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide

C14H18N2O2 — CID 15020109

IUPACN-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide
SMILESO=C(NC1CN2CCC1CC2)c1ccccc1O
InChIInChI=1S/C14H18N2O2/c17-13-4-2-1-3-11(13)14(18)15-12-9-16-7-5-10(12)6-8-16/h1-4,10,12,17H,5-9H2,(H,15,18)
InChIKeyBWPXQIVOSAQNHI-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.22
Rot. Bonds2

About N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide

N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide (PubChem CID 15020109) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide
PubChem CID15020109
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC NameN-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide
SMILESO=C(NC1CN2CCC1CC2)c1ccccc1O
InChIInChI=1S/C14H18N2O2/c17-13-4-2-1-3-11(13)14(18)15-12-9-16-7-5-10(12)6-8-16/h1-4,10,12,17H,5-9H2,(H,15,18)
InChIKeyBWPXQIVOSAQNHI-UHFFFAOYSA-N
XLogP1.22
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydrazinylbenzamide
CID 55052611
N-(1-azabicyclo[2.2.2]octan-3-yl)benzamide;hydrochloride
CID 19766290
N-(1-azabicyclo[2.2.2]octan-3-yl)-5-chloronaphthalene-1-carboxamide
CID 3996470
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-ethoxybenzamide
CID 68666556
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-methoxybenzamide;oxalic acid
CID 24834277
N-(1-azabicyclo[2.2.2]octan-3-yl)-1-methylindole-3-carboxamide
CID 14578824
N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]quinoline-8-carboxamide
CID 69380368
N-(1-azabicyclo[2.2.2]octan-3-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62214906
N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-2-methyl-5-phenylbenzamide
CID 11415960
N-(1-azabicyclo[2.2.2]octan-3-yl)-2,5-dimethylbenzamide
CID 91948829
N-(1-azabicyclo[2.2.2]octan-3-yl)-2,4-dichlorobenzamide
CID 3523885
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-benzyl-3-ethylbenzamide
CID 134869175

Frequently Asked Questions

What is the IUPAC name of N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide?
The IUPAC name of N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide (CID 15020109) is N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide.
What is the SMILES notation for N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide?
The canonical SMILES for N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide is O=C(NC1CN2CCC1CC2)c1ccccc1O.
What is the InChIKey of N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide?
The InChIKey is BWPXQIVOSAQNHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c17-13-4-2-1-3-11(13)14(18)15-12-9-16-7-5-10(12)6-8-16/h1-4,10,12,17H,5-9H2,(H,15,18).
What are the key properties of N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide?
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide has a molecular weight of 246.31 g/mol, XLogP of 1.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-azabicyclo[2.2.2]octan-3-yl)-2-hydroxybenzamide is sourced from PubChem (CID 15020109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).