N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide

C24H20N4O2 — CID 44540223

IUPACN-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide
SMILESCOc1cc(C)ccc1C(=O)Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12
InChIInChI=1S/C24H20N4O2/c1-14-6-7-18(23(10-14)30-2)24(29)27-21-11-15(12-22-19(21)13-26-28-22)16-4-3-5-20-17(16)8-9-25-20/h3-13,25H,1-2H3,(H,26,28)(H,27,29)
InChIKeyHRWFIYQOOLRUTC-UHFFFAOYSA-N
MW396.45 g/mol
LogP5.28
Rot. Bonds4

About N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide

N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide (PubChem CID 44540223) has the molecular formula C24H20N4O2 and a molecular weight of 396.45 g/mol. Its IUPAC name is N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide.

Molecular Properties

Compound NameN-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide
PubChem CID44540223
Molecular FormulaC24H20N4O2
Molecular Weight396.45 g/mol
Exact Mass396.16
IUPAC NameN-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide
SMILESCOc1cc(C)ccc1C(=O)Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12
InChIInChI=1S/C24H20N4O2/c1-14-6-7-18(23(10-14)30-2)24(29)27-21-11-15(12-22-19(21)13-26-28-22)16-4-3-5-20-17(16)8-9-25-20/h3-13,25H,1-2H3,(H,26,28)(H,27,29)
InChIKeyHRWFIYQOOLRUTC-UHFFFAOYSA-N
XLogP5.28
TPSA82.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.45
LogP ≤ 55.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-difluoro-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]benzamide
CID 44540134
2-ethoxy-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]pyridine-3-carboxamide
CID 44540319
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-1-methylimidazole-2-carboxamide
CID 44540326
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-1,2-dimethyl-5-(trifluoromethyl)imidazole-4-carboxamide
CID 143903858
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-propan-2-yltriazole-4-carboxamide
CID 44539853
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 44540160
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-5-propan-2-yl-1,3-oxazole-4-carboxamide
CID 44539956
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-5-(trifluoromethyl)furan-2-carboxamide;5-(trifluoromethyl)furan-2-carboxylic acid
CID 159646958
(Z)-4-[amino(methyl)amino]-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methylidenebut-3-enamide
CID 89122382
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-1-methylsulfonylpiperidine-4-carboxamide
CID 44540312
6-[(4,4-dimethylpiperidin-1-yl)methyl]-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]pyridine-2-carboxamide
CID 44540140
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-6-[[4-(2-methylpropyl)piperazin-1-yl]methyl]pyridine-2-carboxamide
CID 44540137

Frequently Asked Questions

What is the IUPAC name of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide?
The IUPAC name of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide (CID 44540223) is N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide.
What is the SMILES notation for N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide?
The canonical SMILES for N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide is COc1cc(C)ccc1C(=O)Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12.
What is the InChIKey of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide?
The InChIKey is HRWFIYQOOLRUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4O2/c1-14-6-7-18(23(10-14)30-2)24(29)27-21-11-15(12-22-19(21)13-26-28-22)16-4-3-5-20-17(16)8-9-25-20/h3-13,25H,1-2H3,(H,26,28)(H,27,29).
What are the key properties of N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide?
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide has a molecular weight of 396.45 g/mol, XLogP of 5.28, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide is sourced from PubChem (CID 44540223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).