1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol

C8H15NO — CID 57283911

IUPAC1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol
SMILESCCC(O)C1CCC=NC1
InChIInChI=1S/C8H15NO/c1-2-8(10)7-4-3-5-9-6-7/h5,7-8,10H,2-4,6H2,1H3
InChIKeyGNYKJRHOPGPBIM-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.24
Rot. Bonds2

About 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol

1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol (PubChem CID 57283911) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol.

Molecular Properties

Compound Name1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol
PubChem CID57283911
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol
SMILESCCC(O)C1CCC=NC1
InChIInChI=1S/C8H15NO/c1-2-8(10)7-4-3-5-9-6-7/h5,7-8,10H,2-4,6H2,1H3
InChIKeyGNYKJRHOPGPBIM-UHFFFAOYSA-N
XLogP1.24
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol?
The IUPAC name of 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol (CID 57283911) is 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol.
What is the SMILES notation for 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol?
The canonical SMILES for 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol is CCC(O)C1CCC=NC1.
What is the InChIKey of 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol?
The InChIKey is GNYKJRHOPGPBIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-8(10)7-4-3-5-9-6-7/h5,7-8,10H,2-4,6H2,1H3.
What are the key properties of 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol?
1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol has a molecular weight of 141.21 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3,4,5-tetrahydropyridin-3-yl)propan-1-ol is sourced from PubChem (CID 57283911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).