[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol

C14H19N3O2 — CID 79159019

IUPAC[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol
SMILESCc1ccc(OCc2cncn2C(C)C)c(CO)n1
InChIInChI=1S/C14H19N3O2/c1-10(2)17-9-15-6-12(17)8-19-14-5-4-11(3)16-13(14)7-18/h4-6,9-10,18H,7-8H2,1-3H3
InChIKeyLWSWEAOTJYHZTE-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.24
Rot. Bonds5

About [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol

[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol (PubChem CID 79159019) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol
PubChem CID79159019
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol
SMILESCc1ccc(OCc2cncn2C(C)C)c(CO)n1
InChIInChI=1S/C14H19N3O2/c1-10(2)17-9-15-6-12(17)8-19-14-5-4-11(3)16-13(14)7-18/h4-6,9-10,18H,7-8H2,1-3H3
InChIKeyLWSWEAOTJYHZTE-UHFFFAOYSA-N
XLogP2.24
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-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

Frequently Asked Questions

What is the IUPAC name of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol?
The IUPAC name of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol (CID 79159019) is [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol.
What is the SMILES notation for [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol?
The canonical SMILES for [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol is Cc1ccc(OCc2cncn2C(C)C)c(CO)n1.
What is the InChIKey of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol?
The InChIKey is LWSWEAOTJYHZTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-10(2)17-9-15-6-12(17)8-19-14-5-4-11(3)16-13(14)7-18/h4-6,9-10,18H,7-8H2,1-3H3.
What are the key properties of [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol?
[6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol has a molecular weight of 261.32 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-3-[(3-propan-2-ylimidazol-4-yl)methoxy]-2-pyridinyl]methanol is sourced from PubChem (CID 79159019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).