2-(3-propan-2-yl-4-pyridinyl)propan-2-ol

C11H17NO — CID 115008742

IUPAC2-(3-propan-2-yl-4-pyridinyl)propan-2-ol
SMILESCC(C)c1cnccc1C(C)(C)O
InChIInChI=1S/C11H17NO/c1-8(2)9-7-12-6-5-10(9)11(3,4)13/h5-8,13H,1-4H3
InChIKeyUMZKTDPDCPMVNS-UHFFFAOYSA-N
MW179.26 g/mol
LogP2.43
Rot. Bonds2

About 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol

2-(3-propan-2-yl-4-pyridinyl)propan-2-ol (PubChem CID 115008742) has the molecular formula C11H17NO and a molecular weight of 179.26 g/mol. Its IUPAC name is 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol.

Molecular Properties

Compound Name2-(3-propan-2-yl-4-pyridinyl)propan-2-ol
PubChem CID115008742
Molecular FormulaC11H17NO
Molecular Weight179.26 g/mol
Exact Mass179.13
IUPAC Name2-(3-propan-2-yl-4-pyridinyl)propan-2-ol
SMILESCC(C)c1cnccc1C(C)(C)O
InChIInChI=1S/C11H17NO/c1-8(2)9-7-12-6-5-10(9)11(3,4)13/h5-8,13H,1-4H3
InChIKeyUMZKTDPDCPMVNS-UHFFFAOYSA-N
XLogP2.43
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.26
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-propan-2-yl-4-pyridinyl)propan-2-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

3-tert-butyl-4-propan-2-ylpyridine
CID 59734411
ethane;2-(3-methyl-4-pyridinyl)propan-2-ol
CID 145265708
2-(4-propan-2-yloxy-3-pyridinyl)propan-2-ol
CID 84666329
3,4-ditert-butylpyridine
CID 13244751
2-(4-methoxy-3-pyridinyl)propan-2-ol
CID 115009163
3-(2-hydroxypropan-2-yl)pyridine-4-carboxylic acid
CID 175712799
4-(bromomethyl)-3-propan-2-ylpyridine
CID 131699764
1-(4-amino-3-pyridinyl)-2-methylpropane-1,2-diol
CID 103449093
3-propan-2-yl-4-(trifluoromethoxy)pyridine
CID 138513813
[4-(trifluoromethyl)-3-pyridinyl]methanediol
CID 162592484
1,2-ditert-butylbenzene;3,4-ditert-butylpyridine
CID 158272482
(2-tert-butylphenyl)-(4-methyl-3-pyridinyl)methanol
CID 115817782

Frequently Asked Questions

What is the IUPAC name of 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol?
The IUPAC name of 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol (CID 115008742) is 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol.
What is the SMILES notation for 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol?
The canonical SMILES for 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol is CC(C)c1cnccc1C(C)(C)O.
What is the InChIKey of 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol?
The InChIKey is UMZKTDPDCPMVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO/c1-8(2)9-7-12-6-5-10(9)11(3,4)13/h5-8,13H,1-4H3.
What are the key properties of 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol?
2-(3-propan-2-yl-4-pyridinyl)propan-2-ol has a molecular weight of 179.26 g/mol, XLogP of 2.43, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-propan-2-yl-4-pyridinyl)propan-2-ol is sourced from PubChem (CID 115008742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).