9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide

C9H16N2O2 — CID 84659651

IUPAC9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide
SMILESNC(=O)C1CC2CNCC(C1)C2O
InChIInChI=1S/C9H16N2O2/c10-9(13)5-1-6-3-11-4-7(2-5)8(6)12/h5-8,11-12H,1-4H2,(H2,10,13)
InChIKeyJPELERUFEDCFCO-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.92
Rot. Bonds1

About 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide

9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide (PubChem CID 84659651) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide.

Molecular Properties

Compound Name9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide
PubChem CID84659651
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide
SMILESNC(=O)C1CC2CNCC(C1)C2O
InChIInChI=1S/C9H16N2O2/c10-9(13)5-1-6-3-11-4-7(2-5)8(6)12/h5-8,11-12H,1-4H2,(H2,10,13)
InChIKeyJPELERUFEDCFCO-UHFFFAOYSA-N
XLogP-0.92
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 53431016
bicyclo[3.1.0]hexane-3-carboxamide;hydrochloride
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CID 117046519
(1S,5S)-3-azabicyclo[3.2.1]octan-8-ol
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CID 25097848
methyl 5-carbamoyl-1,2,3,3a,4,5,6,6a-octahydropentalene-2-carboxylate
CID 166848927
1,2,3,4,4a,5,7,7a-octahydrofuro[3,4-b]pyridine-3-carboxamide
CID 175691811
propan-2-yl 1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-5-carboxylate
CID 25094471
cyclopentyl 1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole-5-carboxylate
CID 25094738
2,3,4,4a,5,6,7,7a-octahydro-1H-pyrrolo[3,4-b]pyridine-3-carboxylic acid
CID 83816195
piperidine-4-carboxamide;trihydrochloride
CID 141114926
azetidine-3-carbonyl chloride
CID 154252527

Frequently Asked Questions

What is the IUPAC name of 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide?
The IUPAC name of 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide (CID 84659651) is 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide.
What is the SMILES notation for 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide?
The canonical SMILES for 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide is NC(=O)C1CC2CNCC(C1)C2O.
What is the InChIKey of 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide?
The InChIKey is JPELERUFEDCFCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c10-9(13)5-1-6-3-11-4-7(2-5)8(6)12/h5-8,11-12H,1-4H2,(H2,10,13).
What are the key properties of 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide?
9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide has a molecular weight of 184.24 g/mol, XLogP of -0.92, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-3-azabicyclo[3.3.1]nonane-7-carboxamide is sourced from PubChem (CID 84659651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).