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

C16H13N5OS — CID 164618457

IUPAC5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
SMILESCn1cc(-c2ccn3c(-c4ccc(C(N)=O)s4)cnc3c2)cn1
InChIInChI=1S/C16H13N5OS/c1-20-9-11(7-19-20)10-4-5-21-12(8-18-15(21)6-10)13-2-3-14(23-13)16(17)22/h2-9H,1H3,(H2,17,22)
InChIKeyDYPBJWHZPHHJCJ-UHFFFAOYSA-N
MW323.38 g/mol
LogP2.56
Rot. Bonds3

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

5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide (PubChem CID 164618457) has the molecular formula C16H13N5OS and a molecular weight of 323.38 g/mol. Its IUPAC name is 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide.

Molecular Properties

Compound Name5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
PubChem CID164618457
Molecular FormulaC16H13N5OS
Molecular Weight323.38 g/mol
Exact Mass323.08
IUPAC Name5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide
SMILESCn1cc(-c2ccn3c(-c4ccc(C(N)=O)s4)cnc3c2)cn1
InChIInChI=1S/C16H13N5OS/c1-20-9-11(7-19-20)10-4-5-21-12(8-18-15(21)6-10)13-2-3-14(23-13)16(17)22/h2-9H,1H3,(H2,17,22)
InChIKeyDYPBJWHZPHHJCJ-UHFFFAOYSA-N
XLogP2.56
TPSA78.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-(3-methylimidazo[1,2-a]pyrimidin-2-yl)phenyl)thiophene-2-carboxamide
CID 7080336
N-((1R,6R)-6-Amino-2,2-difluorocyclohexyl)-5-methyl-4-(6-(1-methyl-1H-pyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-3-yl)thiophene-2-carboxamide
CID 25141108
N-[(1R,2S)-2-aminocyclohexyl]-4-[6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrimidin-3-yl]thiophene-2-carboxamide
CID 59603842
Mark-IN-4
CID 68776463
US11098041, Example 132
CID 121249676
5-(2-methylpyrimidin-4-yl)-N-[1-(6-prop-2-enoyl-6-azaspiro[3.4]octan-2-yl)benzimidazol-2-yl]thiophene-2-carboxamide
CID 134277828
US10100058, Example 108
CID 134539513
US10100058, Example 4
CID 134539764
US10100058, Example 105
CID 134540034
US10100058, Example 228
CID 134540119
N-[2-(dimethylamino)ethyl]-3-(6-thiophen-2-ylimidazo[1,2-b]pyridazin-3-yl)benzamide
CID 137227337
N-(1-(2-hydroxy-2-methylpropyl)-5-((methyl(pyridin-3-ylmethyl)amino)methyl)-1H-benzo[d]imidazol-2(3H)-ylidene)-5-(1H-pyrazol-4-yl)thiophene-2-carboxamide
CID 44573424

Frequently Asked Questions

What is the IUPAC name of 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide?
The IUPAC name of 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide (CID 164618457) is 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide.
What is the SMILES notation for 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide?
The canonical SMILES for 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide is Cn1cc(-c2ccn3c(-c4ccc(C(N)=O)s4)cnc3c2)cn1.
What is the InChIKey of 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide?
The InChIKey is DYPBJWHZPHHJCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N5OS/c1-20-9-11(7-19-20)10-4-5-21-12(8-18-15(21)6-10)13-2-3-14(23-13)16(17)22/h2-9H,1H3,(H2,17,22).
What are the key properties of 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide?
5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide has a molecular weight of 323.38 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[7-(1-methylpyrazol-4-yl)imidazo[1,2-a]pyridin-3-yl]thiophene-2-carboxamide is sourced from PubChem (CID 164618457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).