N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide

C18H18N6O2S — CID 175971341

IUPACN,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide
SMILESCc1cc(S(=O)(=O)N(C)Cc2ncc(-c3ccccn3)[nH]2)c2[nH]ncc2c1
InChIInChI=1S/C18H18N6O2S/c1-12-7-13-9-21-23-18(13)16(8-12)27(25,26)24(2)11-17-20-10-15(22-17)14-5-3-4-6-19-14/h3-10H,11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyIKKDIVSIUXBLJZ-UHFFFAOYSA-N
MW382.45 g/mol
LogP2.48
Rot. Bonds5

About N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide

N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide (PubChem CID 175971341) has the molecular formula C18H18N6O2S and a molecular weight of 382.45 g/mol. Its IUPAC name is N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide.

Molecular Properties

Compound NameN,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide
PubChem CID175971341
Molecular FormulaC18H18N6O2S
Molecular Weight382.45 g/mol
Exact Mass382.12
IUPAC NameN,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide
SMILESCc1cc(S(=O)(=O)N(C)Cc2ncc(-c3ccccn3)[nH]2)c2[nH]ncc2c1
InChIInChI=1S/C18H18N6O2S/c1-12-7-13-9-21-23-18(13)16(8-12)27(25,26)24(2)11-17-20-10-15(22-17)14-5-3-4-6-19-14/h3-10H,11H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyIKKDIVSIUXBLJZ-UHFFFAOYSA-N
XLogP2.48
TPSA107.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.45
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-2-[[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]methyl]-1H-imidazole-5-carboxamide
CID 175971325
2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-quinolin-7-ylacetamide
CID 171395555
2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]-N-(2-oxo-1,3-dihydroindol-3-yl)acetamide
CID 171395462
1-(5-pyridin-2-yl-1H-imidazol-2-yl)-4-(2,4,6-trimethylphenyl)butan-2-one
CID 160531362
N-(3-chloro-4-methoxyphenyl)-2-[methyl-[(5-methyl-1H-indazol-7-yl)sulfonyl]amino]acetamide
CID 167168339
2-methyl-4-(5-pyridin-2-yl-1H-imidazol-2-yl)butan-2-amine
CID 116877273
2-methyl-3-(5-pyridin-2-yl-1H-imidazol-2-yl)propan-1-amine
CID 116877075
5-methyl-N-propan-2-yl-N-(pyridin-2-ylmethyl)-1H-pyrazole-4-sulfonamide
CID 60959944
3,5-dimethyl-N-[2-oxo-2-[(5-pyridin-2-yl-1H-pyrazol-4-yl)amino]ethyl]benzamide
CID 86796993
3-(5-pyridin-2-yl-1H-imidazol-2-yl)propan-1-ol
CID 116878481
2-amino-N-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-sulfonamide
CID 64517173
2-chloro-N-methyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-sulfonamide
CID 64517471

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide?
The IUPAC name of N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide (CID 175971341) is N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide.
What is the SMILES notation for N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide?
The canonical SMILES for N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide is Cc1cc(S(=O)(=O)N(C)Cc2ncc(-c3ccccn3)[nH]2)c2[nH]ncc2c1.
What is the InChIKey of N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide?
The InChIKey is IKKDIVSIUXBLJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O2S/c1-12-7-13-9-21-23-18(13)16(8-12)27(25,26)24(2)11-17-20-10-15(22-17)14-5-3-4-6-19-14/h3-10H,11H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide?
N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide has a molecular weight of 382.45 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-[(5-pyridin-2-yl-1H-imidazol-2-yl)methyl]-1H-indazole-7-sulfonamide is sourced from PubChem (CID 175971341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).