4-(1-propylimidazol-4-yl)pyridine

C11H13N3 — CID 173238933

IUPAC4-(1-propylimidazol-4-yl)pyridine
SMILESCCCn1cnc(-c2ccncc2)c1
InChIInChI=1S/C11H13N3/c1-2-7-14-8-11(13-9-14)10-3-5-12-6-4-10/h3-6,8-9H,2,7H2,1H3
InChIKeyJYHFZNFEDDBTBW-UHFFFAOYSA-N
MW187.25 g/mol
LogP2.36
Rot. Bonds3

About 4-(1-propylimidazol-4-yl)pyridine

4-(1-propylimidazol-4-yl)pyridine (PubChem CID 173238933) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is 4-(1-propylimidazol-4-yl)pyridine.

Molecular Properties

Compound Name4-(1-propylimidazol-4-yl)pyridine
PubChem CID173238933
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name4-(1-propylimidazol-4-yl)pyridine
SMILESCCCn1cnc(-c2ccncc2)c1
InChIInChI=1S/C11H13N3/c1-2-7-14-8-11(13-9-14)10-3-5-12-6-4-10/h3-6,8-9H,2,7H2,1H3
InChIKeyJYHFZNFEDDBTBW-UHFFFAOYSA-N
XLogP2.36
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(1-propylimidazol-4-yl)pyridine?
The IUPAC name of 4-(1-propylimidazol-4-yl)pyridine (CID 173238933) is 4-(1-propylimidazol-4-yl)pyridine.
What is the SMILES notation for 4-(1-propylimidazol-4-yl)pyridine?
The canonical SMILES for 4-(1-propylimidazol-4-yl)pyridine is CCCn1cnc(-c2ccncc2)c1.
What is the InChIKey of 4-(1-propylimidazol-4-yl)pyridine?
The InChIKey is JYHFZNFEDDBTBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3/c1-2-7-14-8-11(13-9-14)10-3-5-12-6-4-10/h3-6,8-9H,2,7H2,1H3.
What are the key properties of 4-(1-propylimidazol-4-yl)pyridine?
4-(1-propylimidazol-4-yl)pyridine has a molecular weight of 187.25 g/mol, XLogP of 2.36, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-propylimidazol-4-yl)pyridine is sourced from PubChem (CID 173238933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).