7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine

C20H15N5S — CID 164616134

IUPAC7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine
SMILESCn1cc(-c2ccn3c(-c4ccc(-c5ccncc5)s4)cnc3c2)cn1
InChIInChI=1S/C20H15N5S/c1-24-13-16(11-23-24)15-6-9-25-17(12-22-20(25)10-15)19-3-2-18(26-19)14-4-7-21-8-5-14/h2-13H,1H3
InChIKeySMRUCMUVDGDVNS-UHFFFAOYSA-N
MW357.44 g/mol
LogP4.53
Rot. Bonds3

About 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine

7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine (PubChem CID 164616134) has the molecular formula C20H15N5S and a molecular weight of 357.44 g/mol. Its IUPAC name is 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine
PubChem CID164616134
Molecular FormulaC20H15N5S
Molecular Weight357.44 g/mol
Exact Mass357.10
IUPAC Name7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine
SMILESCn1cc(-c2ccn3c(-c4ccc(-c5ccncc5)s4)cnc3c2)cn1
InChIInChI=1S/C20H15N5S/c1-24-13-16(11-23-24)15-6-9-25-17(12-22-20(25)10-15)19-3-2-18(26-19)14-4-7-21-8-5-14/h2-13H,1H3
InChIKeySMRUCMUVDGDVNS-UHFFFAOYSA-N
XLogP4.53
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.44
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine (CID 164616134) is 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine is Cn1cc(-c2ccn3c(-c4ccc(-c5ccncc5)s4)cnc3c2)cn1.
What is the InChIKey of 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine?
The InChIKey is SMRUCMUVDGDVNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5S/c1-24-13-16(11-23-24)15-6-9-25-17(12-22-20(25)10-15)19-3-2-18(26-19)14-4-7-21-8-5-14/h2-13H,1H3.
What are the key properties of 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine?
7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine has a molecular weight of 357.44 g/mol, XLogP of 4.53, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1-methylpyrazol-4-yl)-3-(5-pyridin-4-ylthiophen-2-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 164616134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).