2-methyl-1-pyridin-2-ylpropan-1-ol

C9H13NO — CID 15785876

IUPAC2-methyl-1-pyridin-2-ylpropan-1-ol
SMILESCC(C)C(O)c1ccccn1
InChIInChI=1S/C9H13NO/c1-7(2)9(11)8-5-3-4-6-10-8/h3-7,9,11H,1-2H3
InChIKeyCWQKDQOZSPOCRK-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.77
Rot. Bonds2

About 2-methyl-1-pyridin-2-ylpropan-1-ol

2-methyl-1-pyridin-2-ylpropan-1-ol (PubChem CID 15785876) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 2-methyl-1-pyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name2-methyl-1-pyridin-2-ylpropan-1-ol
PubChem CID15785876
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name2-methyl-1-pyridin-2-ylpropan-1-ol
SMILESCC(C)C(O)c1ccccn1
InChIInChI=1S/C9H13NO/c1-7(2)9(11)8-5-3-4-6-10-8/h3-7,9,11H,1-2H3
InChIKeyCWQKDQOZSPOCRK-UHFFFAOYSA-N
XLogP1.77
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-pyridin-2-ylpropan-1-ol?
The IUPAC name of 2-methyl-1-pyridin-2-ylpropan-1-ol (CID 15785876) is 2-methyl-1-pyridin-2-ylpropan-1-ol.
What is the SMILES notation for 2-methyl-1-pyridin-2-ylpropan-1-ol?
The canonical SMILES for 2-methyl-1-pyridin-2-ylpropan-1-ol is CC(C)C(O)c1ccccn1.
What is the InChIKey of 2-methyl-1-pyridin-2-ylpropan-1-ol?
The InChIKey is CWQKDQOZSPOCRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-7(2)9(11)8-5-3-4-6-10-8/h3-7,9,11H,1-2H3.
What are the key properties of 2-methyl-1-pyridin-2-ylpropan-1-ol?
2-methyl-1-pyridin-2-ylpropan-1-ol has a molecular weight of 151.21 g/mol, XLogP of 1.77, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-pyridin-2-ylpropan-1-ol is sourced from PubChem (CID 15785876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).