3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide

C16H23N3O2 — CID 648116

IUPAC3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide
SMILESCCCNC(=O)N1C2CCC1CC(O)(c1cccnc1)C2
InChIInChI=1S/C16H23N3O2/c1-2-7-18-15(20)19-13-5-6-14(19)10-16(21,9-13)12-4-3-8-17-11-12/h3-4,8,11,13-14,21H,2,5-7,9-10H2,1H3,(H,18,20)
InChIKeyZAUMOTUQYBQDCY-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.02
Rot. Bonds3

About 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide

3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide (PubChem CID 648116) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide
PubChem CID648116
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide
SMILESCCCNC(=O)N1C2CCC1CC(O)(c1cccnc1)C2
InChIInChI=1S/C16H23N3O2/c1-2-7-18-15(20)19-13-5-6-14(19)10-16(21,9-13)12-4-3-8-17-11-12/h3-4,8,11,13-14,21H,2,5-7,9-10H2,1H3,(H,18,20)
InChIKeyZAUMOTUQYBQDCY-UHFFFAOYSA-N
XLogP2.02
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-hydroxy-3-pyridin-3-yl-8-azabicyclo[3.2.1]octan-8-yl)-thiophen-2-ylmethanone
CID 649299
N-propyl-3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)-8-azabicyclo[3.2.1]octane-8-carboxamide
CID 171141508
N-(3,4-dimethoxyphenyl)-2-[(1S,5R)-3-hydroxy-3-pyridin-3-yl-8-azabicyclo[3.2.1]octan-8-yl]acetamide
CID 1446912
3-propan-2-yl-1-pyridin-3-ylcyclobutan-1-ol
CID 103564024
ethyl 5-hydroxy-5-pyridin-3-yl-2-azabicyclo[2.2.1]heptane-2-carboxylate
CID 139841291
N-propyl-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide
CID 47139414
(1S,5S)-N-benzyl-3-hydroxy-3-(1-methylimidazol-2-yl)-8-azabicyclo[3.2.1]octane-8-carboxamide
CID 98060175
2-[(4-cyclopropyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(propylcarbamoyl)acetamide
CID 8917372
N-benzyl-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
CID 1446435
tert-butyl 3-cyano-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 18519989
8-prop-2-enoyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-3-carbonitrile
CID 139797967
benzyl 3-hydroxy-3-pyrimidin-5-yl-8-azabicyclo[3.2.1]octane-8-carboxylate
CID 171951838

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
The IUPAC name of 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide (CID 648116) is 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide.
What is the SMILES notation for 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
The canonical SMILES for 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide is CCCNC(=O)N1C2CCC1CC(O)(c1cccnc1)C2.
What is the InChIKey of 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
The InChIKey is ZAUMOTUQYBQDCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-2-7-18-15(20)19-13-5-6-14(19)10-16(21,9-13)12-4-3-8-17-11-12/h3-4,8,11,13-14,21H,2,5-7,9-10H2,1H3,(H,18,20).
What are the key properties of 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide?
3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-propyl-3-pyridin-3-yl-8-azabicyclo[3.2.1]octane-8-carboxamide is sourced from PubChem (CID 648116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).