2-methyl-1-pyridin-2-ylbutan-1-ol

C10H15NO — CID 79444533

IUPAC2-methyl-1-pyridin-2-ylbutan-1-ol
SMILESCCC(C)C(O)c1ccccn1
InChIInChI=1S/C10H15NO/c1-3-8(2)10(12)9-6-4-5-7-11-9/h4-8,10,12H,3H2,1-2H3
InChIKeyLEZZVRZQQGIRIG-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.16
Rot. Bonds3

About 2-methyl-1-pyridin-2-ylbutan-1-ol

2-methyl-1-pyridin-2-ylbutan-1-ol (PubChem CID 79444533) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2-methyl-1-pyridin-2-ylbutan-1-ol.

Molecular Properties

Compound Name2-methyl-1-pyridin-2-ylbutan-1-ol
PubChem CID79444533
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2-methyl-1-pyridin-2-ylbutan-1-ol
SMILESCCC(C)C(O)c1ccccn1
InChIInChI=1S/C10H15NO/c1-3-8(2)10(12)9-6-4-5-7-11-9/h4-8,10,12H,3H2,1-2H3
InChIKeyLEZZVRZQQGIRIG-UHFFFAOYSA-N
XLogP2.16
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-1-pyridin-2-ylbutan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1S)-2-methyl-1-pyridin-2-ylpropan-1-ol
CID 51670363
(1S,2S)-1-pyridin-2-ylpropane-1,2-diol
CID 28766943
(2S)-2-methoxy-1-pyridin-2-ylpropan-1-ol
CID 131085993
2-amino-3-methyl-1-pyridin-2-ylbutan-1-ol
CID 82280795
(1S)-1-pyridin-2-ylethanol;hydrochloride
CID 71757448
3-methyl-N-[(1S)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81402254
ethyl (2S,3R)-2-amino-3-hydroxy-3-pyridin-2-ylpropanoate
CID 124510790
(2S)-2-amino-3-methyl-N-[(1R)-1-pyridin-2-ylethyl]pentanamide
CID 81407362
(3S,4R)-4-hydroxy-3-methyl-4-pyridin-2-ylbutan-2-one
CID 130697576
ethane;2-pentan-3-ylpyridine
CID 142883968
2-(3-bromo-4-ethylhexan-2-yl)pyridine
CID 66453992
1-[[(1S)-1-pyridin-2-ylethyl]amino]butan-2-ol
CID 81401299

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-pyridin-2-ylbutan-1-ol?
The IUPAC name of 2-methyl-1-pyridin-2-ylbutan-1-ol (CID 79444533) is 2-methyl-1-pyridin-2-ylbutan-1-ol.
What is the SMILES notation for 2-methyl-1-pyridin-2-ylbutan-1-ol?
The canonical SMILES for 2-methyl-1-pyridin-2-ylbutan-1-ol is CCC(C)C(O)c1ccccn1.
What is the InChIKey of 2-methyl-1-pyridin-2-ylbutan-1-ol?
The InChIKey is LEZZVRZQQGIRIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-3-8(2)10(12)9-6-4-5-7-11-9/h4-8,10,12H,3H2,1-2H3.
What are the key properties of 2-methyl-1-pyridin-2-ylbutan-1-ol?
2-methyl-1-pyridin-2-ylbutan-1-ol has a molecular weight of 165.24 g/mol, XLogP of 2.16, 3 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-ylbutan-1-ol is sourced from PubChem (CID 79444533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).