N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide

C15H23N5O2S — CID 126917333

IUPACN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide
SMILESCN(C1CN(c2ccc(C3CC3)nn2)C1)S(=O)(=O)N1CCCC1
InChIInChI=1S/C15H23N5O2S/c1-18(23(21,22)20-8-2-3-9-20)13-10-19(11-13)15-7-6-14(16-17-15)12-4-5-12/h6-7,12-13H,2-5,8-11H2,1H3
InChIKeyDCDBMPQDLQTUGD-UHFFFAOYSA-N
MW337.45 g/mol
LogP0.81
Rot. Bonds5

About N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide

N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide (PubChem CID 126917333) has the molecular formula C15H23N5O2S and a molecular weight of 337.45 g/mol. Its IUPAC name is N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide
PubChem CID126917333
Molecular FormulaC15H23N5O2S
Molecular Weight337.45 g/mol
Exact Mass337.16
IUPAC NameN-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide
SMILESCN(C1CN(c2ccc(C3CC3)nn2)C1)S(=O)(=O)N1CCCC1
InChIInChI=1S/C15H23N5O2S/c1-18(23(21,22)20-8-2-3-9-20)13-10-19(11-13)15-7-6-14(16-17-15)12-4-5-12/h6-7,12-13H,2-5,8-11H2,1H3
InChIKeyDCDBMPQDLQTUGD-UHFFFAOYSA-N
XLogP0.81
TPSA69.64 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.45
LogP ≤ 50.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N,1-dimethylimidazole-2-sulfonamide
CID 126917414
3-[[[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-methylamino]methyl]-1-methylsulfonylpiperidin-3-ol
CID 126917626
3-cyclopentyl-1-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-1-methylurea
CID 126917267
1-cyclopropyl-3-[[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-methylamino]pyrrolidin-2-one
CID 126917564
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyloxolane-2-carboxamide
CID 126917260
2-N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-2-N,4-N,4-N-trimethylpyrimidine-2,4-diamine
CID 126917402
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-(2-morpholin-4-ylethyl)azetidin-3-amine
CID 126917365
1-(6-cyclopropylpyridazin-3-yl)-N-[(1,1-dioxothiolan-3-yl)methyl]-N-methylazetidin-3-amine
CID 126917570
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine
CID 126917536
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-amine
CID 126917591
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
CID 126917395
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-(1,2-thiazol-4-ylmethyl)azetidin-3-amine
CID 126917524

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide?
The IUPAC name of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide (CID 126917333) is N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide.
What is the SMILES notation for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide?
The canonical SMILES for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide is CN(C1CN(c2ccc(C3CC3)nn2)C1)S(=O)(=O)N1CCCC1.
What is the InChIKey of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide?
The InChIKey is DCDBMPQDLQTUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2S/c1-18(23(21,22)20-8-2-3-9-20)13-10-19(11-13)15-7-6-14(16-17-15)12-4-5-12/h6-7,12-13H,2-5,8-11H2,1H3.
What are the key properties of N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide?
N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide has a molecular weight of 337.45 g/mol, XLogP of 0.81, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]-N-methylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 126917333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).