1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide

C24H24N6O — CID 58356412

IUPAC1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide
SMILESCCn1nc(C(C)C)cc1C(=O)Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12
InChIInChI=1S/C24H24N6O/c1-4-30-23(12-20(29-30)14(2)3)24(31)27-21-10-15(11-22-18(21)13-26-28-22)16-6-5-7-19-17(16)8-9-25-19/h5-14,25H,4H2,1-3H3,(H,26,28)(H,27,31)
InChIKeyORQKDZPPCJRGFV-UHFFFAOYSA-N
MW412.50 g/mol
LogP5.30
Rot. Bonds5

About 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide

1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide (PubChem CID 58356412) has the molecular formula C24H24N6O and a molecular weight of 412.50 g/mol. Its IUPAC name is 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide
PubChem CID58356412
Molecular FormulaC24H24N6O
Molecular Weight412.50 g/mol
Exact Mass412.20
IUPAC Name1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide
SMILESCCn1nc(C(C)C)cc1C(=O)Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12
InChIInChI=1S/C24H24N6O/c1-4-30-23(12-20(29-30)14(2)3)24(31)27-21-10-15(11-22-18(21)13-26-28-22)16-6-5-7-19-17(16)8-9-25-19/h5-14,25H,4H2,1-3H3,(H,26,28)(H,27,31)
InChIKeyORQKDZPPCJRGFV-UHFFFAOYSA-N
XLogP5.30
TPSA91.39 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.50
LogP ≤ 55.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

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
2,6-difluoro-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]benzamide
CID 44540134
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-1-methylimidazole-2-carboxamide
CID 44540326
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]-6-[[4-(2-methylpropyl)piperazin-1-yl]methyl]pyridine-2-carboxamide
CID 44540137
N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-methoxy-4-methylbenzamide
CID 44540223
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]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 44540491
1-[(2-chlorophenyl)methyl]-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]pyrazole-3-carboxamide
CID 53240846
formic acid;N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-2-[(4-pentan-3-ylpiperazin-1-yl)methyl]-1,3-thiazole-4-carboxamide
CID 158088924

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide?
The IUPAC name of 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide (CID 58356412) is 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide.
What is the SMILES notation for 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide?
The canonical SMILES for 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide is CCn1nc(C(C)C)cc1C(=O)Nc1cc(-c2cccc3[nH]ccc23)cc2[nH]ncc12.
What is the InChIKey of 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide?
The InChIKey is ORQKDZPPCJRGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N6O/c1-4-30-23(12-20(29-30)14(2)3)24(31)27-21-10-15(11-22-18(21)13-26-28-22)16-6-5-7-19-17(16)8-9-25-19/h5-14,25H,4H2,1-3H3,(H,26,28)(H,27,31).
What are the key properties of 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide?
1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide has a molecular weight of 412.50 g/mol, XLogP of 5.30, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[6-(1H-indol-4-yl)-1H-indazol-4-yl]-3-propan-2-ylpyrazole-5-carboxamide is sourced from PubChem (CID 58356412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).