N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide

C12H19N3O2S — CID 112552145

IUPACN-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide
SMILESCc1nc(S(=O)(=O)NC2CC2)c2n1CCC(C)C2
InChIInChI=1S/C12H19N3O2S/c1-8-5-6-15-9(2)13-12(11(15)7-8)18(16,17)14-10-3-4-10/h8,10,14H,3-7H2,1-2H3
InChIKeyPKRANUQKTNRCJT-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.21
Rot. Bonds3

About N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide

N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide (PubChem CID 112552145) has the molecular formula C12H19N3O2S and a molecular weight of 269.37 g/mol. Its IUPAC name is N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide
PubChem CID112552145
Molecular FormulaC12H19N3O2S
Molecular Weight269.37 g/mol
Exact Mass269.12
IUPAC NameN-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide
SMILESCc1nc(S(=O)(=O)NC2CC2)c2n1CCC(C)C2
InChIInChI=1S/C12H19N3O2S/c1-8-5-6-15-9(2)13-12(11(15)7-8)18(16,17)14-10-3-4-10/h8,10,14H,3-7H2,1-2H3
InChIKeyPKRANUQKTNRCJT-UHFFFAOYSA-N
XLogP1.21
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide?
The IUPAC name of N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide (CID 112552145) is N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide.
What is the SMILES notation for N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide?
The canonical SMILES for N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide is Cc1nc(S(=O)(=O)NC2CC2)c2n1CCC(C)C2.
What is the InChIKey of N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide?
The InChIKey is PKRANUQKTNRCJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2S/c1-8-5-6-15-9(2)13-12(11(15)7-8)18(16,17)14-10-3-4-10/h8,10,14H,3-7H2,1-2H3.
What are the key properties of N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide?
N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide has a molecular weight of 269.37 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3,7-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1-sulfonamide is sourced from PubChem (CID 112552145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).