2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide

C16H17N5O2S — CID 166308837

IUPAC2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide
SMILESCn1nc2ccccc2c1S(=O)(=O)NC1CN(c2ccncc2)C1
InChIInChI=1S/C16H17N5O2S/c1-20-16(14-4-2-3-5-15(14)18-20)24(22,23)19-12-10-21(11-12)13-6-8-17-9-7-13/h2-9,12,19H,10-11H2,1H3
InChIKeyAYEZLEIFJUZUMF-UHFFFAOYSA-N
MW343.41 g/mol
LogP1.14
Rot. Bonds4

About 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide

2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide (PubChem CID 166308837) has the molecular formula C16H17N5O2S and a molecular weight of 343.41 g/mol. Its IUPAC name is 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide
PubChem CID166308837
Molecular FormulaC16H17N5O2S
Molecular Weight343.41 g/mol
Exact Mass343.11
IUPAC Name2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide
SMILESCn1nc2ccccc2c1S(=O)(=O)NC1CN(c2ccncc2)C1
InChIInChI=1S/C16H17N5O2S/c1-20-16(14-4-2-3-5-15(14)18-20)24(22,23)19-12-10-21(11-12)13-6-8-17-9-7-13/h2-9,12,19H,10-11H2,1H3
InChIKeyAYEZLEIFJUZUMF-UHFFFAOYSA-N
XLogP1.14
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.41
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methyl-N-(5-piperazin-1-yl-2-pyridinyl)indazole-3-sulfonamide
CID 167990453
2-methyl-N-[[4-(sulfamoylmethyl)phenyl]methyl]indazole-3-sulfonamide
CID 167886311
N-(1-pyridin-4-ylpiperidin-4-yl)-1-benzothiophene-3-sulfonamide
CID 166282079
N-(2-benzylsulfanylethyl)-2-methylindazole-3-sulfonamide
CID 166339654
N-[(3R)-1-quinazolin-4-ylpiperidin-3-yl]methanesulfonamide
CID 36834296
methyl 1-pyridin-4-ylazetidine-3-carboxylate
CID 175714274
N-(1-quinolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide
CID 155800764
N-(1-quinazolin-4-ylpiperidin-3-yl)cyclopropanesulfonamide
CID 154829981
N-(1-phenylpiperidin-4-yl)isoquinoline-5-sulfonamide
CID 126775893
N-(1-quinazolin-4-ylpiperidin-3-yl)propane-2-sulfonamide
CID 175650317
2-(1,3-dioxoisoindol-2-yl)-N-(1-pyridin-4-ylpiperidin-4-yl)ethanesulfonamide
CID 66624402
2-methyl-4-(4-pyridin-4-ylpiperazine-1-carbonyl)phthalazin-1-one
CID 9254342

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide?
The IUPAC name of 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide (CID 166308837) is 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide.
What is the SMILES notation for 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide?
The canonical SMILES for 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide is Cn1nc2ccccc2c1S(=O)(=O)NC1CN(c2ccncc2)C1.
What is the InChIKey of 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide?
The InChIKey is AYEZLEIFJUZUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O2S/c1-20-16(14-4-2-3-5-15(14)18-20)24(22,23)19-12-10-21(11-12)13-6-8-17-9-7-13/h2-9,12,19H,10-11H2,1H3.
What are the key properties of 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide?
2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide has a molecular weight of 343.41 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1-pyridin-4-ylazetidin-3-yl)indazole-3-sulfonamide is sourced from PubChem (CID 166308837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).