N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide

C16H18N4O — CID 115680666

IUPACN-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide
SMILESCCc1cn[nH]c1NC(=O)Cc1c(C)[nH]c2ccccc12
InChIInChI=1S/C16H18N4O/c1-3-11-9-17-20-16(11)19-15(21)8-13-10(2)18-14-7-5-4-6-12(13)14/h4-7,9,18H,3,8H2,1-2H3,(H2,17,19,20,21)
InChIKeyDHLSGZGPKAWETM-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.94
Rot. Bonds4

About N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide

N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide (PubChem CID 115680666) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide
PubChem CID115680666
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC NameN-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide
SMILESCCc1cn[nH]c1NC(=O)Cc1c(C)[nH]c2ccccc12
InChIInChI=1S/C16H18N4O/c1-3-11-9-17-20-16(11)19-15(21)8-13-10(2)18-14-7-5-4-6-12(13)14/h4-7,9,18H,3,8H2,1-2H3,(H2,17,19,20,21)
InChIKeyDHLSGZGPKAWETM-UHFFFAOYSA-N
XLogP2.94
TPSA73.57 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

N-(4-ethyl-1H-pyrazol-5-yl)-2-naphthalen-1-ylacetamide
CID 115680720
N-(2-hydroxyphenyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31984043
2-(2-methyl-1H-indol-3-yl)-N-(6-methyl-2-pyridinyl)acetamide
CID 31903883
2-(2-methyl-1H-indol-3-yl)-N-(5-phenyl-1,3-thiazol-2-yl)acetamide
CID 86979349
2-(2-methyl-1H-indol-3-yl)-N-(5-nitro-1,3-thiazol-2-yl)acetamide
CID 23658504
2-(2-methyl-1H-indol-3-yl)-N-[(5-oxo-1,4-dihydro-1,2,4-triazol-3-yl)methyl]acetamide
CID 137200070
2-(2-methyl-1H-indol-3-yl)-N-(1-methyl-4-phenylpyrazol-5-yl)acetamide
CID 155909077
2-(2-methyl-1H-indol-3-yl)-N-(2,3,4-trifluorophenyl)acetamide
CID 113211384
N-(3-chlorophenyl)-2-(2-methyl-1H-indol-3-yl)acetamide
CID 31856117
3-ethyl-2-methyl-1H-indole;propane
CID 156727003
(2S,3S)-3-methyl-2-[[2-(2-methyl-1H-indol-3-yl)acetyl]amino]pentanoic acid
CID 119194327
2-(2-methyl-1H-indol-3-yl)-N-[2-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 60555655

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide?
The IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide (CID 115680666) is N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide is CCc1cn[nH]c1NC(=O)Cc1c(C)[nH]c2ccccc12.
What is the InChIKey of N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide?
The InChIKey is DHLSGZGPKAWETM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-3-11-9-17-20-16(11)19-15(21)8-13-10(2)18-14-7-5-4-6-12(13)14/h4-7,9,18H,3,8H2,1-2H3,(H2,17,19,20,21).
What are the key properties of N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide?
N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide has a molecular weight of 282.35 g/mol, XLogP of 2.94, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1H-pyrazol-5-yl)-2-(2-methyl-1H-indol-3-yl)acetamide is sourced from PubChem (CID 115680666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).