N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide

C18H18N4O3S — CID 6539600

IUPACN-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide
SMILESCS(=O)(=O)Nc1ccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)cc1
InChIInChI=1S/C18H18N4O3S/c1-26(24,25)22-14-7-4-11(5-8-14)13-6-9-15-16(10-13)20-21-17(15)19-18(23)12-2-3-12/h4-10,12,22H,2-3H2,1H3,(H2,19,20,21,23)
InChIKeyPXDJFHKHAHQLSC-UHFFFAOYSA-N
MW370.43 g/mol
LogP2.95
Rot. Bonds5

About N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide

N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide (PubChem CID 6539600) has the molecular formula C18H18N4O3S and a molecular weight of 370.43 g/mol. Its IUPAC name is N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide
PubChem CID6539600
Molecular FormulaC18H18N4O3S
Molecular Weight370.43 g/mol
Exact Mass370.11
IUPAC NameN-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide
SMILESCS(=O)(=O)Nc1ccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)cc1
InChIInChI=1S/C18H18N4O3S/c1-26(24,25)22-14-7-4-11(5-8-14)13-6-9-15-16(10-13)20-21-17(15)19-18(23)12-2-3-12/h4-10,12,22H,2-3H2,1H3,(H2,19,20,21,23)
InChIKeyPXDJFHKHAHQLSC-UHFFFAOYSA-N
XLogP2.95
TPSA103.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.43
LogP ≤ 52.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

Sgc aak1 1
CID 134812845
Sgc-cdkl2/aak1/bmp2K-1
CID 155543077
N-(5-phenyl-1H-indazol-3-yl)butanamide
CID 6539551
N-(6-phenyl-1H-indazol-3-yl)cyclopropanecarboxamide
CID 6539593
N-[6-(2,5-difluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539603
N-[6-(3-fluorophenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539606
N-(6-phenyl-1H-indazol-3-yl)butyramide
CID 10085013
N-(6-(4-aminophenyl)-1H-indazol-3-yl)butyramide
CID 10085818
N-(5-(1,1-Dioxidoisothiazolidin-2-YL)-1H-indazol-3-YL)-2-(4-piperidin-1-ylphenyl)acetamide
CID 10138993
N-(6,7-difluoro-5-phenyl-1H-indazol-3-yl)butanamide
CID 22319609
N-[6-(4-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539597
N-[6-(3-sulfamoylphenyl)-1H-indazol-3-yl]cyclopropanecarboxamide
CID 6539598

Frequently Asked Questions

What is the IUPAC name of N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide (CID 6539600) is N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide is CS(=O)(=O)Nc1ccc(-c2ccc3c(NC(=O)C4CC4)n[nH]c3c2)cc1.
What is the InChIKey of N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide?
The InChIKey is PXDJFHKHAHQLSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O3S/c1-26(24,25)22-14-7-4-11(5-8-14)13-6-9-15-16(10-13)20-21-17(15)19-18(23)12-2-3-12/h4-10,12,22H,2-3H2,1H3,(H2,19,20,21,23).
What are the key properties of N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide?
N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide has a molecular weight of 370.43 g/mol, XLogP of 2.95, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-(methanesulfonamido)phenyl]-1H-indazol-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 6539600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).