2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide

C20H19N5O3S — CID 171395555

IUPAC2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide
SMILESCc1cc(S(=O)(=O)N(C)CC(=O)Nc2ccc3cccnc3c2)c2[nH]ncc2c1
InChIInChI=1S/C20H19N5O3S/c1-13-8-15-11-22-24-20(15)18(9-13)29(27,28)25(2)12-19(26)23-16-6-5-14-4-3-7-21-17(14)10-16/h3-11H,12H2,1-2H3,(H,22,24)(H,23,26)
InChIKeyOOYPYELJTVWLSO-UHFFFAOYSA-N
MW409.47 g/mol
LogP2.68
Rot. Bonds5

About 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide

2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide (PubChem CID 171395555) has the molecular formula C20H19N5O3S and a molecular weight of 409.47 g/mol. Its IUPAC name is 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide.

Molecular Properties

Compound Name2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide
PubChem CID171395555
Molecular FormulaC20H19N5O3S
Molecular Weight409.47 g/mol
Exact Mass409.12
IUPAC Name2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide
SMILESCc1cc(S(=O)(=O)N(C)CC(=O)Nc2ccc3cccnc3c2)c2[nH]ncc2c1
InChIInChI=1S/C20H19N5O3S/c1-13-8-15-11-22-24-20(15)18(9-13)29(27,28)25(2)12-19(26)23-16-6-5-14-4-3-7-21-17(14)10-16/h3-11H,12H2,1-2H3,(H,22,24)(H,23,26)
InChIKeyOOYPYELJTVWLSO-UHFFFAOYSA-N
XLogP2.68
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.47
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-chloro-4-methoxyphenyl)-2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]acetamide
CID 167168339
1-[(5-methyl-1H-indazol-7-yl)sulfonyl]-N-quinolin-7-ylazetidine-2-carboxamide
CID 171395425
N-(4-acetyl-2,3-dihydro-1,4-benzoxazin-7-yl)-2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]acetamide
CID 171442855
2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-(2-oxo-1,3-dihydroindol-3-yl)acetamide
CID 171395462
2-[ethyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-(3-methyl-4-morpholin-4-ylphenyl)acetamide
CID 171442889
N-(7aH-isoindol-5-yl)-2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]acetamide
CID 171442859
N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-2-[ethyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]acetamide
CID 171442771
N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[4,5-c]pyridin-2-yl)-2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]acetamide
CID 164573617
N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide
CID 175971341
2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-naphthalen-2-ylacetamide
CID 9403525
N,N-dimethyl-2-[[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]methyl]-1H-imidazole-5-carboxamide
CID 175971325
2-[(4-fluorophenyl)sulfonyl-methylamino]-N-quinolin-3-ylacetamide
CID 18146512

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide?
The IUPAC name of 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide (CID 171395555) is 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide.
What is the SMILES notation for 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide?
The canonical SMILES for 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide is Cc1cc(S(=O)(=O)N(C)CC(=O)Nc2ccc3cccnc3c2)c2[nH]ncc2c1.
What is the InChIKey of 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide?
The InChIKey is OOYPYELJTVWLSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O3S/c1-13-8-15-11-22-24-20(15)18(9-13)29(27,28)25(2)12-19(26)23-16-6-5-14-4-3-7-21-17(14)10-16/h3-11H,12H2,1-2H3,(H,22,24)(H,23,26).
What are the key properties of 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide?
2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide has a molecular weight of 409.47 g/mol, XLogP of 2.68, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide is sourced from PubChem (CID 171395555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).