1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine

C8H15NO — CID 91348701

IUPAC1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine
SMILESCC(C)C1=CN(O)CCC1
InChIInChI=1S/C8H15NO/c1-7(2)8-4-3-5-9(10)6-8/h6-7,10H,3-5H2,1-2H3
InChIKeyLQITWINWLCVUOK-UHFFFAOYSA-N
MW141.21 g/mol
LogP2.01
Rot. Bonds1

About 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine

1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine (PubChem CID 91348701) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine
PubChem CID91348701
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine
SMILESCC(C)C1=CN(O)CCC1
InChIInChI=1S/C8H15NO/c1-7(2)8-4-3-5-9(10)6-8/h6-7,10H,3-5H2,1-2H3
InChIKeyLQITWINWLCVUOK-UHFFFAOYSA-N
XLogP2.01
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine?
The IUPAC name of 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine (CID 91348701) is 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine?
The canonical SMILES for 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine is CC(C)C1=CN(O)CCC1.
What is the InChIKey of 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine?
The InChIKey is LQITWINWLCVUOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-7(2)8-4-3-5-9(10)6-8/h6-7,10H,3-5H2,1-2H3.
What are the key properties of 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine?
1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine has a molecular weight of 141.21 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-5-propan-2-yl-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 91348701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).