2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide

C26H28N4O2 — CID 53383365

IUPAC2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide
SMILESCCCCCNC(=O)C(C1CC1)n1c(=O)c(-c2cc3ccccc3[nH]2)nc2ccccc21
InChIInChI=1S/C26H28N4O2/c1-2-3-8-15-27-25(31)24(17-13-14-17)30-22-12-7-6-11-20(22)29-23(26(30)32)21-16-18-9-4-5-10-19(18)28-21/h4-7,9-12,16-17,24,28H,2-3,8,13-15H2,1H3,(H,27,31)
InChIKeyICCZNCSGBITDGK-UHFFFAOYSA-N
MW428.54 g/mol
LogP4.80
Rot. Bonds8

About 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide

2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide (PubChem CID 53383365) has the molecular formula C26H28N4O2 and a molecular weight of 428.54 g/mol. Its IUPAC name is 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide.

Molecular Properties

Compound Name2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide
PubChem CID53383365
Molecular FormulaC26H28N4O2
Molecular Weight428.54 g/mol
Exact Mass428.22
IUPAC Name2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide
SMILESCCCCCNC(=O)C(C1CC1)n1c(=O)c(-c2cc3ccccc3[nH]2)nc2ccccc21
InChIInChI=1S/C26H28N4O2/c1-2-3-8-15-27-25(31)24(17-13-14-17)30-22-12-7-6-11-20(22)29-23(26(30)32)21-16-18-9-4-5-10-19(18)28-21/h4-7,9-12,16-17,24,28H,2-3,8,13-15H2,1H3,(H,27,31)
InChIKeyICCZNCSGBITDGK-UHFFFAOYSA-N
XLogP4.80
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.54
LogP ≤ 54.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyclopropyl-2-(2-oxo-3-phenylquinoxalin-1-yl)-N-pentylacetamide
CID 53383108
N-benzyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-4-phenylbutanamide
CID 53383368
2-(1-benzofuran-2-yl)-N-tert-butyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]acetamide
CID 53383405
2-(2-oxo-3-phenylquinoxalin-1-yl)-N-pentyl-4-phenylbutanamide
CID 53383103
2-(1-benzofuran-2-yl)-2-[3-(furan-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide
CID 53383147
2-[1-(difluoromethyl)benzimidazol-2-yl]sulfanyl-N-pentylacetamide
CID 33247965
N-butyl-2-[1-(1H-indole-2-carbonyl)piperidin-4-yl]propanamide
CID 50816867
N-[1-(dodecylamino)-3-hydroxy-1-oxobutan-2-yl]-1H-indole-2-carboxamide
CID 123483320
N-[(2S,3R)-1-(dodecylamino)-3-hydroxy-1-oxobutan-2-yl]-1H-indole-2-carboxamide
CID 90111390
N-(1-cyclopropylethyl)decan-1-amine;1H-indol-2-ylmethanamine
CID 159137270
N-[5-(1-hexadecylbenzimidazol-2-yl)pentyl]-2-methylpropanamide
CID 16988638
N-dodecyl-2,2-diphenylacetamide
CID 5143289

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide?
The IUPAC name of 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide (CID 53383365) is 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide.
What is the SMILES notation for 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide?
The canonical SMILES for 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide is CCCCCNC(=O)C(C1CC1)n1c(=O)c(-c2cc3ccccc3[nH]2)nc2ccccc21.
What is the InChIKey of 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide?
The InChIKey is ICCZNCSGBITDGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N4O2/c1-2-3-8-15-27-25(31)24(17-13-14-17)30-22-12-7-6-11-20(22)29-23(26(30)32)21-16-18-9-4-5-10-19(18)28-21/h4-7,9-12,16-17,24,28H,2-3,8,13-15H2,1H3,(H,27,31).
What are the key properties of 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide?
2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide has a molecular weight of 428.54 g/mol, XLogP of 4.80, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[3-(1H-indol-2-yl)-2-oxoquinoxalin-1-yl]-N-pentylacetamide is sourced from PubChem (CID 53383365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).