N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

C10H16N4O3S — CID 103307867

About N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide

N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (PubChem CID 103307867) has the molecular formula C10H16N4O3S and a molecular weight of 272.33 g/mol. Its IUPAC name is N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.

Molecular Properties

• Compound Name: N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
• PubChem CID: 103307867
• Molecular Formula: C10H16N4O3S
• Molecular Weight: 272.33 g/mol
• Exact Mass: 272.09
• IUPAC Name: N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide
• SMILES: CC(C)S(=O)(=O)NC(=O)C1Cc2nc[nH]c2CN1
• InChI: InChI=1S/C10H16N4O3S/c1-6(2)18(16,17)14-10(15)8-3-7-9(4-11-8)13-5-12-7/h5-6,8,11H,3-4H2,1-2H3,(H,12,13)(H,14,15)
• InChIKey: MZNIQCOWDRKUHY-UHFFFAOYSA-N
• XLogP: -0.72
• TPSA: 103.95 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 18
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	272.33
LogP ≤ 5	-0.72
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?

The IUPAC name of N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide (CID 103307867) is N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide.

What is the SMILES notation for N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?

The canonical SMILES for N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is CC(C)S(=O)(=O)NC(=O)C1Cc2nc[nH]c2CN1.

What is the InChIKey of N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?

The InChIKey is MZNIQCOWDRKUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3S/c1-6(2)18(16,17)14-10(15)8-3-7-9(4-11-8)13-5-12-7/h5-6,8,11H,3-4H2,1-2H3,(H,12,13)(H,14,15).

What are the key properties of N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide?

N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide has a molecular weight of 272.33 g/mol, XLogP of -0.72, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-propan-2-ylsulfonyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxamide is sourced from PubChem (CID 103307867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).