1-propylimidazole;quinoline

C15H17N3 — CID 174946070

IUPAC1-propylimidazole;quinoline
SMILESCCCn1ccnc1.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C6H10N2/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-4-8-5-3-7-6-8/h1-7H;3,5-6H,2,4H2,1H3
InChIKeyUQJJSEQYTIXQMI-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.53
Rot. Bonds2

About 1-propylimidazole;quinoline

1-propylimidazole;quinoline (PubChem CID 174946070) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-propylimidazole;quinoline.

Molecular Properties

Compound Name1-propylimidazole;quinoline
PubChem CID174946070
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name1-propylimidazole;quinoline
SMILESCCCn1ccnc1.c1ccc2ncccc2c1
InChIInChI=1S/C9H7N.C6H10N2/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-4-8-5-3-7-6-8/h1-7H;3,5-6H,2,4H2,1H3
InChIKeyUQJJSEQYTIXQMI-UHFFFAOYSA-N
XLogP3.53
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-propylimidazole;quinoline?
The IUPAC name of 1-propylimidazole;quinoline (CID 174946070) is 1-propylimidazole;quinoline.
What is the SMILES notation for 1-propylimidazole;quinoline?
The canonical SMILES for 1-propylimidazole;quinoline is CCCn1ccnc1.c1ccc2ncccc2c1.
What is the InChIKey of 1-propylimidazole;quinoline?
The InChIKey is UQJJSEQYTIXQMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N.C6H10N2/c1-2-6-9-8(4-1)5-3-7-10-9;1-2-4-8-5-3-7-6-8/h1-7H;3,5-6H,2,4H2,1H3.
What are the key properties of 1-propylimidazole;quinoline?
1-propylimidazole;quinoline has a molecular weight of 239.32 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propylimidazole;quinoline is sourced from PubChem (CID 174946070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).