1-propan-2-yl-2H-pyridin-2-ol

C8H13NO — CID 154218989

IUPAC1-propan-2-yl-2H-pyridin-2-ol
SMILESCC(C)N1C=CC=CC1O
InChIInChI=1S/C8H13NO/c1-7(2)9-6-4-3-5-8(9)10/h3-8,10H,1-2H3
InChIKeyQWJAOVSXZPUNSM-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.10
Rot. Bonds1

About 1-propan-2-yl-2H-pyridin-2-ol

1-propan-2-yl-2H-pyridin-2-ol (PubChem CID 154218989) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 1-propan-2-yl-2H-pyridin-2-ol.

Molecular Properties

Compound Name1-propan-2-yl-2H-pyridin-2-ol
PubChem CID154218989
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name1-propan-2-yl-2H-pyridin-2-ol
SMILESCC(C)N1C=CC=CC1O
InChIInChI=1S/C8H13NO/c1-7(2)9-6-4-3-5-8(9)10/h3-8,10H,1-2H3
InChIKeyQWJAOVSXZPUNSM-UHFFFAOYSA-N
XLogP1.10
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-2H-pyridin-2-ol?
The IUPAC name of 1-propan-2-yl-2H-pyridin-2-ol (CID 154218989) is 1-propan-2-yl-2H-pyridin-2-ol.
What is the SMILES notation for 1-propan-2-yl-2H-pyridin-2-ol?
The canonical SMILES for 1-propan-2-yl-2H-pyridin-2-ol is CC(C)N1C=CC=CC1O.
What is the InChIKey of 1-propan-2-yl-2H-pyridin-2-ol?
The InChIKey is QWJAOVSXZPUNSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-7(2)9-6-4-3-5-8(9)10/h3-8,10H,1-2H3.
What are the key properties of 1-propan-2-yl-2H-pyridin-2-ol?
1-propan-2-yl-2H-pyridin-2-ol has a molecular weight of 139.20 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-2H-pyridin-2-ol is sourced from PubChem (CID 154218989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).