N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide

C15H20N6O2S — CID 126917414

IUPACN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide
SMILESCN(C1CN(c2ccc(C3CC3)nn2)C1)S(=O)(=O)c1nccn1C
InChIInChI=1S/C15H20N6O2S/c1-19-8-7-16-15(19)24(22,23)20(2)12-9-21(10-12)14-6-5-13(17-18-14)11-3-4-11/h5-8,11-12H,3-4,9-10H2,1-2H3
InChIKeyDQNQYMMPCSZUMD-UHFFFAOYSA-N
MW348.43 g/mol
LogP0.60
Rot. Bonds5

About N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide

N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide (PubChem CID 126917414) has the molecular formula C15H20N6O2S and a molecular weight of 348.43 g/mol. Its IUPAC name is N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide.

Molecular Properties

Compound NameN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide
PubChem CID126917414
Molecular FormulaC15H20N6O2S
Molecular Weight348.43 g/mol
Exact Mass348.14
IUPAC NameN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide
SMILESCN(C1CN(c2ccc(C3CC3)nn2)C1)S(=O)(=O)c1nccn1C
InChIInChI=1S/C15H20N6O2S/c1-19-8-7-16-15(19)24(22,23)20(2)12-9-21(10-12)14-6-5-13(17-18-14)11-3-4-11/h5-8,11-12H,3-4,9-10H2,1-2H3
InChIKeyDQNQYMMPCSZUMD-UHFFFAOYSA-N
XLogP0.60
TPSA84.22 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide
CID 126917333
3-cyclopentyl-1-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-1-methylurea
CID 126917267
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrazolo[1,5-a]pyrazin-4-amine
CID 126917388
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]azetidin-3-amine
CID 126917379
2-N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-2-N,4-N,4-N-trimethylpyrimidine-2,4-diamine
CID 126917402
1-[2-[[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-methylamino]ethyl]pyridin-2-one
CID 126917477
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine
CID 126917536
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-(2-morpholin-4-ylethyl)azetidin-3-amine
CID 126917365
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]azetidin-3-amine
CID 126917500
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[1-(1,2,4-oxadiazol-5-yl)ethyl]azetidin-3-amine
CID 126917482
1-(6-cyclopropylpyridazin-3-yl)-N-[(1,1-dioxothiolan-3-yl)methyl]-N-methylazetidin-3-amine
CID 126917570
1-cyclopropyl-3-[[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-methylamino]pyrrolidin-2-one
CID 126917564

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide?
The IUPAC name of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide (CID 126917414) is N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide.
What is the SMILES notation for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide?
The canonical SMILES for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide is CN(C1CN(c2ccc(C3CC3)nn2)C1)S(=O)(=O)c1nccn1C.
What is the InChIKey of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide?
The InChIKey is DQNQYMMPCSZUMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O2S/c1-19-8-7-16-15(19)24(22,23)20(2)12-9-21(10-12)14-6-5-13(17-18-14)11-3-4-11/h5-8,11-12H,3-4,9-10H2,1-2H3.
What are the key properties of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide?
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide has a molecular weight of 348.43 g/mol, XLogP of 0.60, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide is sourced from PubChem (CID 126917414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).