2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide

C21H23N3O — CID 69061785

IUPAC2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide
SMILESCc1ccc(-c2ccc3c(NC(=O)CC4CCCC4)n[nH]c3c2)cc1
InChIInChI=1S/C21H23N3O/c1-14-6-8-16(9-7-14)17-10-11-18-19(13-17)23-24-21(18)22-20(25)12-15-4-2-3-5-15/h6-11,13,15H,2-5,12H2,1H3,(H2,22,23,24,25)
InChIKeyZUSQHYRUWCNHBG-UHFFFAOYSA-N
MW333.44 g/mol
LogP5.06
Rot. Bonds4

About 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide

2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide (PubChem CID 69061785) has the molecular formula C21H23N3O and a molecular weight of 333.44 g/mol. Its IUPAC name is 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide
PubChem CID69061785
Molecular FormulaC21H23N3O
Molecular Weight333.44 g/mol
Exact Mass333.18
IUPAC Name2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide
SMILESCc1ccc(-c2ccc3c(NC(=O)CC4CCCC4)n[nH]c3c2)cc1
InChIInChI=1S/C21H23N3O/c1-14-6-8-16(9-7-14)17-10-11-18-19(13-17)23-24-21(18)22-20(25)12-15-4-2-3-5-15/h6-11,13,15H,2-5,12H2,1H3,(H2,22,23,24,25)
InChIKeyZUSQHYRUWCNHBG-UHFFFAOYSA-N
XLogP5.06
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.44
LogP ≤ 55.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopentyl-N-[6-(4-fluorophenyl)-1H-indazol-3-yl]acetamide
CID 69060428
2-cyclopentyl-N-[6-(3-fluorophenyl)-1H-indazol-3-yl]acetamide
CID 69060880
2-cyclopentyl-N-(1H-indazol-3-yl)acetamide
CID 55023308
N-[6-(3-methylphenyl)-1H-indazol-3-yl]cyclohexanecarboxamide
CID 69065843
N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperidine-1-carboxamide
CID 69064183
N-[6-(2,5-dimethylphenyl)-1H-indazol-3-yl]cyclohexanecarboxamide
CID 69065189
N-(6-phenyl-1H-indazol-3-yl)cyclohexanecarboxamide
CID 69063558
N-[2-[[6-(4-methylphenyl)-1H-indazol-3-yl]carbamoylamino]ethyl]acetamide
CID 69091931
N-[6-(4-chlorophenyl)-1H-indazol-3-yl]butanamide
CID 22319587
N-[6-(4-methylphenyl)-1H-indazol-3-yl]piperazine-1-carboxamide
CID 69063807
1-(3-hydroxypropyl)-3-[6-(4-methylphenyl)-1H-indazol-3-yl]urea
CID 69064539
2-cyclopentyl-N-(4,5-dimethyl-1H-pyrazol-3-yl)acetamide
CID 115610162

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide?
The IUPAC name of 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide (CID 69061785) is 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide is Cc1ccc(-c2ccc3c(NC(=O)CC4CCCC4)n[nH]c3c2)cc1.
What is the InChIKey of 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide?
The InChIKey is ZUSQHYRUWCNHBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O/c1-14-6-8-16(9-7-14)17-10-11-18-19(13-17)23-24-21(18)22-20(25)12-15-4-2-3-5-15/h6-11,13,15H,2-5,12H2,1H3,(H2,22,23,24,25).
What are the key properties of 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide?
2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide has a molecular weight of 333.44 g/mol, XLogP of 5.06, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-[6-(4-methylphenyl)-1H-indazol-3-yl]acetamide is sourced from PubChem (CID 69061785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).