3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide

C16H19N3O4S — CID 167834575

IUPAC3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide
SMILESCc1c(C(=O)NS(=O)(=O)C2CCOC2)ccc2cnc(C3CC3)n12
InChIInChI=1S/C16H19N3O4S/c1-10-14(16(20)18-24(21,22)13-6-7-23-9-13)5-4-12-8-17-15(19(10)12)11-2-3-11/h4-5,8,11,13H,2-3,6-7,9H2,1H3,(H,18,20)
InChIKeyVASPGROLRWSYOV-UHFFFAOYSA-N
MW349.41 g/mol
LogP1.37
Rot. Bonds4

About 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide

3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide (PubChem CID 167834575) has the molecular formula C16H19N3O4S and a molecular weight of 349.41 g/mol. Its IUPAC name is 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide
PubChem CID167834575
Molecular FormulaC16H19N3O4S
Molecular Weight349.41 g/mol
Exact Mass349.11
IUPAC Name3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide
SMILESCc1c(C(=O)NS(=O)(=O)C2CCOC2)ccc2cnc(C3CC3)n12
InChIInChI=1S/C16H19N3O4S/c1-10-14(16(20)18-24(21,22)13-6-7-23-9-13)5-4-12-8-17-15(19(10)12)11-2-3-11/h4-5,8,11,13H,2-3,6-7,9H2,1H3,(H,18,20)
InChIKeyVASPGROLRWSYOV-UHFFFAOYSA-N
XLogP1.37
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide (CID 167834575) is 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide is Cc1c(C(=O)NS(=O)(=O)C2CCOC2)ccc2cnc(C3CC3)n12.
What is the InChIKey of 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide?
The InChIKey is VASPGROLRWSYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4S/c1-10-14(16(20)18-24(21,22)13-6-7-23-9-13)5-4-12-8-17-15(19(10)12)11-2-3-11/h4-5,8,11,13H,2-3,6-7,9H2,1H3,(H,18,20).
What are the key properties of 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide?
3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide has a molecular weight of 349.41 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-methyl-N-(oxolan-3-ylsulfonyl)imidazo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 167834575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).