2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol

C8H15NO — CID 55286795

IUPAC2-(1,2,3,6-tetrahydropyridin-6-yl)propan-2-ol
SMILESCC(C)(C1C=CCCN1)O
InChIInChI=1S/C8H15NO/c1-8(2,10)7-5-3-4-6-9-7/h3,5,7,9-10H,4,6H2,1-2H3
InChIKeyZQNGGJNAOQNZLS-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.50
Rot. Bonds1

About 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol

2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol (PubChem CID 55286795) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-(1,2,3,6-tetrahydropyridin-6-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol
PubChem CID55286795
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-(1,2,3,6-tetrahydropyridin-6-yl)propan-2-ol
SMILESCC(C)(C1C=CCCN1)O
InChIInChI=1S/C8H15NO/c1-8(2,10)7-5-3-4-6-9-7/h3,5,7,9-10H,4,6H2,1-2H3
InChIKeyZQNGGJNAOQNZLS-UHFFFAOYSA-N
XLogP0.50
TPSA32.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity140

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(Z)-2-fluoro-3-(fluoromethyl)-4-(propylamino)hept-5-en-3-ol
CID 167082463
2-(6-Methyl-1,2-dihydropyridin-2-yl)propan-2-ol
CID 90247451
6-(Ethylamino)-6-methylcyclohexa-1,3-dien-1-ol
CID 139892088
2-Methyl-1,2,3,6-tetrahydropyridin-5-ol
CID 141896531
2-(6-Bromo-1,2-dihydropyridin-2-yl)propan-2-ol
CID 143930436
(4E)-4-ethenyl-2-methyl-3-(propan-2-ylamino)hepta-4,6-dien-2-ol
CID 145636556
1-[(3S)-3-ethyl-1,2,3,6-tetrahydropyridin-2-yl]ethenol
CID 146773660
2-(1,2-Dihydropyridin-2-yl)propan-2-ol
CID 148824024
1-[[(E)-hept-5-en-2-yl]amino]-2-methylpropan-2-ol
CID 149162872
2-(4-Ethyl-1,2-dihydropyridin-2-yl)propan-2-ol
CID 155201098
Ethane;2-(4-ethyl-1,2-dihydropyridin-2-yl)propan-2-ol
CID 155709660
(E)-2-methyl-6-(methylamino)hex-4-en-2-ol
CID 164153412

Frequently Asked Questions

What is the IUPAC name of 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol?
The IUPAC name of 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol (CID 55286795) is 2-(1,2,3,6-tetrahydropyridin-6-yl)propan-2-ol.
What is the SMILES notation for 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol?
The canonical SMILES for 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol is CC(C)(C1C=CCCN1)O.
What is the InChIKey of 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol?
The InChIKey is ZQNGGJNAOQNZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-8(2,10)7-5-3-4-6-9-7/h3,5,7,9-10H,4,6H2,1-2H3.
What are the key properties of 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol?
2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol has a molecular weight of 141.21 g/mol, XLogP of 0.50, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2,3,6-Tetrahydropyridin-6-yl)propan-2-ol is sourced from PubChem (CID 55286795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).