(4-butyl-3-pyridinyl)methanol

C10H15NO — CID 173058896

IUPAC(4-butyl-3-pyridinyl)methanol
SMILESCCCCc1ccncc1CO
InChIInChI=1S/C10H15NO/c1-2-3-4-9-5-6-11-7-10(9)8-12/h5-7,12H,2-4,8H2,1H3
InChIKeyJHBCZVIFLQPXRD-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.92
Rot. Bonds4

About (4-butyl-3-pyridinyl)methanol

(4-butyl-3-pyridinyl)methanol (PubChem CID 173058896) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (4-butyl-3-pyridinyl)methanol.

Molecular Properties

Compound Name(4-butyl-3-pyridinyl)methanol
PubChem CID173058896
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(4-butyl-3-pyridinyl)methanol
SMILESCCCCc1ccncc1CO
InChIInChI=1S/C10H15NO/c1-2-3-4-9-5-6-11-7-10(9)8-12/h5-7,12H,2-4,8H2,1H3
InChIKeyJHBCZVIFLQPXRD-UHFFFAOYSA-N
XLogP1.92
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-butyl-3-pyridinyl)methanol 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

ethane;(4-ethyl-3-pyridinyl)methanol;propane
CID 142370025
[4-(bromomethyl)-3-pyridinyl]methanol
CID 139484815
4-heptyl-3-methylpyridine
CID 143666243
5-butylisoquinolin-8-ol
CID 137082898
4-hexylpyridine-3-carboxylic acid
CID 54526352
3-methoxy-4-pentylpyridine
CID 170214218
3,4,5-tributylpyridine
CID 173010708
2-(3-pentyl-4-pyridinyl)phenol
CID 135745178
(2-octylphenyl)methanol
CID 19826681
[3-[(3,5-dimethylphenyl)methyl]-4-pyridinyl]methanol
CID 54432913
(4-propyl-3-pyridinyl)methanesulfonic acid
CID 174773543
[3-(diethylamino)-4-pyridinyl]methanol
CID 105066644

Frequently Asked Questions

What is the IUPAC name of (4-butyl-3-pyridinyl)methanol?
The IUPAC name of (4-butyl-3-pyridinyl)methanol (CID 173058896) is (4-butyl-3-pyridinyl)methanol.
What is the SMILES notation for (4-butyl-3-pyridinyl)methanol?
The canonical SMILES for (4-butyl-3-pyridinyl)methanol is CCCCc1ccncc1CO.
What is the InChIKey of (4-butyl-3-pyridinyl)methanol?
The InChIKey is JHBCZVIFLQPXRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-2-3-4-9-5-6-11-7-10(9)8-12/h5-7,12H,2-4,8H2,1H3.
What are the key properties of (4-butyl-3-pyridinyl)methanol?
(4-butyl-3-pyridinyl)methanol has a molecular weight of 165.24 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-butyl-3-pyridinyl)methanol is sourced from PubChem (CID 173058896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).