2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine

C18H15FN6 — CID 11393470

IUPAC2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine
SMILESCc1c(-c2ccc3nc(C4CC4)cn3c2)nnn1-c1cccnc1F
InChIInChI=1S/C18H15FN6/c1-11-17(22-23-25(11)15-3-2-8-20-18(15)19)13-6-7-16-21-14(12-4-5-12)10-24(16)9-13/h2-3,6-10,12H,4-5H2,1H3
InChIKeyNBAJQXGUSJEKMU-UHFFFAOYSA-N
MW334.36 g/mol
LogP3.30
Rot. Bonds3

About 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine

2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine (PubChem CID 11393470) has the molecular formula C18H15FN6 and a molecular weight of 334.36 g/mol. Its IUPAC name is 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine
PubChem CID11393470
Molecular FormulaC18H15FN6
Molecular Weight334.36 g/mol
Exact Mass334.13
IUPAC Name2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine
SMILESCc1c(-c2ccc3nc(C4CC4)cn3c2)nnn1-c1cccnc1F
InChIInChI=1S/C18H15FN6/c1-11-17(22-23-25(11)15-3-2-8-20-18(15)19)13-6-7-16-21-14(12-4-5-12)10-24(16)9-13/h2-3,6-10,12H,4-5H2,1H3
InChIKeyNBAJQXGUSJEKMU-UHFFFAOYSA-N
XLogP3.30
TPSA60.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.36
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine (CID 11393470) is 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine is Cc1c(-c2ccc3nc(C4CC4)cn3c2)nnn1-c1cccnc1F.
What is the InChIKey of 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine?
The InChIKey is NBAJQXGUSJEKMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN6/c1-11-17(22-23-25(11)15-3-2-8-20-18(15)19)13-6-7-16-21-14(12-4-5-12)10-24(16)9-13/h2-3,6-10,12H,4-5H2,1H3.
What are the key properties of 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine?
2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine has a molecular weight of 334.36 g/mol, XLogP of 3.30, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-6-[1-(2-fluoro-3-pyridinyl)-5-methyltriazol-4-yl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 11393470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).