3-(3-butylimidazol-4-yl)pyridine

C12H15N3 — CID 174388983

IUPAC3-(3-butylimidazol-4-yl)pyridine
SMILESCCCCn1cncc1-c1cccnc1
InChIInChI=1S/C12H15N3/c1-2-3-7-15-10-14-9-12(15)11-5-4-6-13-8-11/h4-6,8-10H,2-3,7H2,1H3
InChIKeyNNHZVFHGOGCBER-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.75
Rot. Bonds4

About 3-(3-butylimidazol-4-yl)pyridine

3-(3-butylimidazol-4-yl)pyridine (PubChem CID 174388983) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 3-(3-butylimidazol-4-yl)pyridine.

Molecular Properties

Compound Name3-(3-butylimidazol-4-yl)pyridine
PubChem CID174388983
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name3-(3-butylimidazol-4-yl)pyridine
SMILESCCCCn1cncc1-c1cccnc1
InChIInChI=1S/C12H15N3/c1-2-3-7-15-10-14-9-12(15)11-5-4-6-13-8-11/h4-6,8-10H,2-3,7H2,1H3
InChIKeyNNHZVFHGOGCBER-UHFFFAOYSA-N
XLogP2.75
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3-octylimidazol-4-yl)pyridin-2-amine
CID 114721585
3-(1-butylimidazol-4-yl)pyridine
CID 58668046
4-(3-pentylimidazol-4-yl)pyridin-2-amine
CID 114716246
1-pentyl-4-pyridin-3-ylimidazol-2-amine
CID 162675846
3-(1-methylpyrrol-2-yl)pyridine
CID 10249
3-(1-methyl(213C)pyrrol-2-yl)(2,3,4,5,6-13C5)pyridine
CID 169444700
4-butyl-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione
CID 2219373
3-(2-methyl-1H-diazet-3-yl)pyridine
CID 144904060
3-butylpyrimidin-4-one
CID 115679478
3-butyl-2-propyl-5-pyridin-3-ylimidazol-4-amine
CID 62219767
1-(3-butylimidazol-4-yl)ethanamine
CID 114702792
3-(2,3-dimethylimidazol-4-yl)pyridine
CID 44549702

Frequently Asked Questions

What is the IUPAC name of 3-(3-butylimidazol-4-yl)pyridine?
The IUPAC name of 3-(3-butylimidazol-4-yl)pyridine (CID 174388983) is 3-(3-butylimidazol-4-yl)pyridine.
What is the SMILES notation for 3-(3-butylimidazol-4-yl)pyridine?
The canonical SMILES for 3-(3-butylimidazol-4-yl)pyridine is CCCCn1cncc1-c1cccnc1.
What is the InChIKey of 3-(3-butylimidazol-4-yl)pyridine?
The InChIKey is NNHZVFHGOGCBER-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-2-3-7-15-10-14-9-12(15)11-5-4-6-13-8-11/h4-6,8-10H,2-3,7H2,1H3.
What are the key properties of 3-(3-butylimidazol-4-yl)pyridine?
3-(3-butylimidazol-4-yl)pyridine has a molecular weight of 201.27 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-butylimidazol-4-yl)pyridine is sourced from PubChem (CID 174388983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).