6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide

C14H10N6OS — CID 67140462

IUPAC6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1nncs1)c1cn2cc(-c3cc[nH]c3)ccc2n1
InChIInChI=1S/C14H10N6OS/c21-13(18-14-19-16-8-22-14)11-7-20-6-10(1-2-12(20)17-11)9-3-4-15-5-9/h1-8,15H,(H,18,19,21)
InChIKeyNVXNQHGGXNXAGQ-UHFFFAOYSA-N
MW310.34 g/mol
LogP2.43
Rot. Bonds3

About 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide

6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 67140462) has the molecular formula C14H10N6OS and a molecular weight of 310.34 g/mol. Its IUPAC name is 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID67140462
Molecular FormulaC14H10N6OS
Molecular Weight310.34 g/mol
Exact Mass310.06
IUPAC Name6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(Nc1nncs1)c1cn2cc(-c3cc[nH]c3)ccc2n1
InChIInChI=1S/C14H10N6OS/c21-13(18-14-19-16-8-22-14)11-7-20-6-10(1-2-12(20)17-11)9-3-4-15-5-9/h1-8,15H,(H,18,19,21)
InChIKeyNVXNQHGGXNXAGQ-UHFFFAOYSA-N
XLogP2.43
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.34
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 118538767
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CID 118538898
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CID 118538972
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Frequently Asked Questions

What is the IUPAC name of 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide (CID 67140462) is 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide is O=C(Nc1nncs1)c1cn2cc(-c3cc[nH]c3)ccc2n1.
What is the InChIKey of 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is NVXNQHGGXNXAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6OS/c21-13(18-14-19-16-8-22-14)11-7-20-6-10(1-2-12(20)17-11)9-3-4-15-5-9/h1-8,15H,(H,18,19,21).
What are the key properties of 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide?
6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 310.34 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-pyrrol-3-yl)-N-(1,3,4-thiadiazol-2-yl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 67140462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).