8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide

C15H19ClN4O4S — CID 129097803

IUPAC8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide
SMILESCON(C)C(=O)c1cc(Cl)c2cncn2c1N1CCS(=O)(=O)C(C)C1
InChIInChI=1S/C15H19ClN4O4S/c1-10-8-19(4-5-25(10,22)23)14-11(15(21)18(2)24-3)6-12(16)13-7-17-9-20(13)14/h6-7,9-10H,4-5,8H2,1-3H3
InChIKeyHGZAWVCBWBDZEY-UHFFFAOYSA-N
MW386.86 g/mol
LogP1.24
Rot. Bonds3

About 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide

8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide (PubChem CID 129097803) has the molecular formula C15H19ClN4O4S and a molecular weight of 386.86 g/mol. Its IUPAC name is 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide.

Molecular Properties

Compound Name8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide
PubChem CID129097803
Molecular FormulaC15H19ClN4O4S
Molecular Weight386.86 g/mol
Exact Mass386.08
IUPAC Name8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide
SMILESCON(C)C(=O)c1cc(Cl)c2cncn2c1N1CCS(=O)(=O)C(C)C1
InChIInChI=1S/C15H19ClN4O4S/c1-10-8-19(4-5-25(10,22)23)14-11(15(21)18(2)24-3)6-12(16)13-7-17-9-20(13)14/h6-7,9-10H,4-5,8H2,1-3H3
InChIKeyHGZAWVCBWBDZEY-UHFFFAOYSA-N
XLogP1.24
TPSA84.22 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.86
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide?
The IUPAC name of 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide (CID 129097803) is 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide.
What is the SMILES notation for 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide?
The canonical SMILES for 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide is CON(C)C(=O)c1cc(Cl)c2cncn2c1N1CCS(=O)(=O)C(C)C1.
What is the InChIKey of 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide?
The InChIKey is HGZAWVCBWBDZEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN4O4S/c1-10-8-19(4-5-25(10,22)23)14-11(15(21)18(2)24-3)6-12(16)13-7-17-9-20(13)14/h6-7,9-10H,4-5,8H2,1-3H3.
What are the key properties of 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide?
8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide has a molecular weight of 386.86 g/mol, XLogP of 1.24, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-N-methoxy-N-methyl-5-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)imidazo[1,5-a]pyridine-6-carboxamide is sourced from PubChem (CID 129097803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).