N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide

C16H17N5OS — CID 154762864

IUPACN-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
SMILESCn1nc(-c2ccsc2)cc1NC(=O)C1CCc2cncn2C1
InChIInChI=1S/C16H17N5OS/c1-20-15(6-14(19-20)12-4-5-23-9-12)18-16(22)11-2-3-13-7-17-10-21(13)8-11/h4-7,9-11H,2-3,8H2,1H3,(H,18,22)
InChIKeyDTBKPJBLPWBQER-UHFFFAOYSA-N
MW327.41 g/mol
LogP2.55
Rot. Bonds3

About N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide

N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide (PubChem CID 154762864) has the molecular formula C16H17N5OS and a molecular weight of 327.41 g/mol. Its IUPAC name is N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
PubChem CID154762864
Molecular FormulaC16H17N5OS
Molecular Weight327.41 g/mol
Exact Mass327.12
IUPAC NameN-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide
SMILESCn1nc(-c2ccsc2)cc1NC(=O)C1CCc2cncn2C1
InChIInChI=1S/C16H17N5OS/c1-20-15(6-14(19-20)12-4-5-23-9-12)18-16(22)11-2-3-13-7-17-10-21(13)8-11/h4-7,9-11H,2-3,8H2,1H3,(H,18,22)
InChIKeyDTBKPJBLPWBQER-UHFFFAOYSA-N
XLogP2.55
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide (CID 154762864) is N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide is Cn1nc(-c2ccsc2)cc1NC(=O)C1CCc2cncn2C1.
What is the InChIKey of N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
The InChIKey is DTBKPJBLPWBQER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5OS/c1-20-15(6-14(19-20)12-4-5-23-9-12)18-16(22)11-2-3-13-7-17-10-21(13)8-11/h4-7,9-11H,2-3,8H2,1H3,(H,18,22).
What are the key properties of N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide?
N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide has a molecular weight of 327.41 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-3-thiophen-3-ylpyrazol-5-yl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 154762864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).