2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine

C12H15N3 — CID 142663682

IUPAC2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine
SMILESCC(C)c1cn(Cc2ccccn2)cn1
InChIInChI=1S/C12H15N3/c1-10(2)12-8-15(9-14-12)7-11-5-3-4-6-13-11/h3-6,8-10H,7H2,1-2H3
InChIKeyOFSOAFDQDIAMAS-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.45
Rot. Bonds3

About 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine

2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine (PubChem CID 142663682) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine.

Molecular Properties

Compound Name2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine
PubChem CID142663682
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine
SMILESCC(C)c1cn(Cc2ccccn2)cn1
InChIInChI=1S/C12H15N3/c1-10(2)12-8-15(9-14-12)7-11-5-3-4-6-13-11/h3-6,8-10H,7H2,1-2H3
InChIKeyOFSOAFDQDIAMAS-UHFFFAOYSA-N
XLogP2.45
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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2-[[4-(2,2-dimethylpropyl)pyrazol-1-yl]methyl]pyridine;hydrochloride
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ethane;2-methylpropane;2-propan-2-ylpyridine
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2-[[4-(methylsulfanylmethyl)triazol-1-yl]methyl]pyridine
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N-[[1-(pyridin-2-ylmethyl)indol-3-yl]methyl]propan-2-amine
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Frequently Asked Questions

What is the IUPAC name of 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine?
The IUPAC name of 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine (CID 142663682) is 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine.
What is the SMILES notation for 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine?
The canonical SMILES for 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine is CC(C)c1cn(Cc2ccccn2)cn1.
What is the InChIKey of 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine?
The InChIKey is OFSOAFDQDIAMAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-10(2)12-8-15(9-14-12)7-11-5-3-4-6-13-11/h3-6,8-10H,7H2,1-2H3.
What are the key properties of 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine?
2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine has a molecular weight of 201.27 g/mol, XLogP of 2.45, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-propan-2-ylimidazol-1-yl)methyl]pyridine is sourced from PubChem (CID 142663682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).