2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide

C17H20N4O — CID 71690037

IUPAC2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCc1nn(C)c(C)c1NC(=O)Cn1c(C)cc2ccccc21
InChIInChI=1S/C17H20N4O/c1-11-9-14-7-5-6-8-15(14)21(11)10-16(22)18-17-12(2)19-20(4)13(17)3/h5-9H,10H2,1-4H3,(H,18,22)
InChIKeyTZXOQDMRYOFLII-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.94
Rot. Bonds3

About 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide

2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide (PubChem CID 71690037) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide.

Molecular Properties

Compound Name2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
PubChem CID71690037
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
SMILESCc1nn(C)c(C)c1NC(=O)Cn1c(C)cc2ccccc21
InChIInChI=1S/C17H20N4O/c1-11-9-14-7-5-6-8-15(14)21(11)10-16(22)18-17-12(2)19-20(4)13(17)3/h5-9H,10H2,1-4H3,(H,18,22)
InChIKeyTZXOQDMRYOFLII-UHFFFAOYSA-N
XLogP2.94
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-ethyl-2-oxobenzimidazol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 47015272
2-(2-methylindol-1-yl)-N-(6-methyl-2-pyridinyl)acetamide
CID 4173283
2-(2-methylindol-1-yl)-N-pyridin-4-ylacetamide
CID 27700402
N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(2-phenylindol-1-yl)acetamide
CID 16575307
N-(4-bromophenyl)-2-(2-methylindol-1-yl)acetamide
CID 4226117
2-(2-methylindol-1-yl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 17460159
2-(3-methyl-2-oxoimidazo[4,5-b]pyridin-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 46958965
2-(naphthalen-1-ylamino)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide
CID 78815389
2-(2-methylindol-1-yl)-N-(1H-1,2,4-triazol-5-yl)acetamide
CID 30865225
2-(2-methylindol-1-yl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
CID 43036916
N-[6-(3,5-dimethylpyrazol-1-yl)-3-pyridinyl]-2-(2-methylindol-1-yl)acetamide
CID 43064755
3-oxo-3-phenyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 110473196

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The IUPAC name of 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide (CID 71690037) is 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide.
What is the SMILES notation for 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The canonical SMILES for 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide is Cc1nn(C)c(C)c1NC(=O)Cn1c(C)cc2ccccc21.
What is the InChIKey of 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
The InChIKey is TZXOQDMRYOFLII-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-11-9-14-7-5-6-8-15(14)21(11)10-16(22)18-17-12(2)19-20(4)13(17)3/h5-9H,10H2,1-4H3,(H,18,22).
What are the key properties of 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide?
2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide has a molecular weight of 296.37 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylindol-1-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide is sourced from PubChem (CID 71690037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).