5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile

C18H10N6S2 — CID 22032109

IUPAC5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile
SMILESN#Cc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4nccs4)n3c2)s1
InChIInChI=1S/C18H10N6S2/c19-7-12-2-3-15(26-12)17-13(8-22-23-17)11-1-4-16-21-9-14(24(16)10-11)18-20-5-6-25-18/h1-6,8-10H,(H,22,23)
InChIKeyJMEPQRPVTVKOSV-UHFFFAOYSA-N
MW374.45 g/mol
LogP4.45
Rot. Bonds3

About 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile

5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile (PubChem CID 22032109) has the molecular formula C18H10N6S2 and a molecular weight of 374.45 g/mol. Its IUPAC name is 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile.

Molecular Properties

Compound Name5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile
PubChem CID22032109
Molecular FormulaC18H10N6S2
Molecular Weight374.45 g/mol
Exact Mass374.04
IUPAC Name5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile
SMILESN#Cc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4nccs4)n3c2)s1
InChIInChI=1S/C18H10N6S2/c19-7-12-2-3-15(26-12)17-13(8-22-23-17)11-1-4-16-21-9-14(24(16)10-11)18-20-5-6-25-18/h1-6,8-10H,(H,22,23)
InChIKeyJMEPQRPVTVKOSV-UHFFFAOYSA-N
XLogP4.45
TPSA82.66 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.45
LogP ≤ 54.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile?
The IUPAC name of 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile (CID 22032109) is 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile.
What is the SMILES notation for 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile?
The canonical SMILES for 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile is N#Cc1ccc(-c2[nH]ncc2-c2ccc3ncc(-c4nccs4)n3c2)s1.
What is the InChIKey of 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile?
The InChIKey is JMEPQRPVTVKOSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10N6S2/c19-7-12-2-3-15(26-12)17-13(8-22-23-17)11-1-4-16-21-9-14(24(16)10-11)18-20-5-6-25-18/h1-6,8-10H,(H,22,23).
What are the key properties of 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile?
5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile has a molecular weight of 374.45 g/mol, XLogP of 4.45, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[3-(1,3-thiazol-2-yl)imidazo[1,2-a]pyridin-6-yl]-1H-pyrazol-5-yl]thiophene-2-carbonitrile is sourced from PubChem (CID 22032109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).