2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide

C24H26N4O2 — CID 71827915

IUPAC2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide
SMILESCC(=O)Nc1cccc2c1ccn2CC(=O)Nc1cccc2c1ccn2CC(C)C
InChIInChI=1S/C24H26N4O2/c1-16(2)14-27-12-10-19-21(7-5-8-22(19)27)26-24(30)15-28-13-11-18-20(25-17(3)29)6-4-9-23(18)28/h4-13,16H,14-15H2,1-3H3,(H,25,29)(H,26,30)
InChIKeySNXAWHZDIFCTBP-UHFFFAOYSA-N
MW402.50 g/mol
LogP4.85
Rot. Bonds6

About 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide

2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide (PubChem CID 71827915) has the molecular formula C24H26N4O2 and a molecular weight of 402.50 g/mol. Its IUPAC name is 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide.

Molecular Properties

Compound Name2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide
PubChem CID71827915
Molecular FormulaC24H26N4O2
Molecular Weight402.50 g/mol
Exact Mass402.21
IUPAC Name2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide
SMILESCC(=O)Nc1cccc2c1ccn2CC(=O)Nc1cccc2c1ccn2CC(C)C
InChIInChI=1S/C24H26N4O2/c1-16(2)14-27-12-10-19-21(7-5-8-22(19)27)26-24(30)15-28-13-11-18-20(25-17(3)29)6-4-9-23(18)28/h4-13,16H,14-15H2,1-3H3,(H,25,29)(H,26,30)
InChIKeySNXAWHZDIFCTBP-UHFFFAOYSA-N
XLogP4.85
TPSA68.06 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl (2S)-2-[[2-(4-acetamidoindol-1-yl)acetyl]amino]-3-methylbutanoate
CID 91638079
2-(4-acetamidoindol-1-yl)-N-(3-acetylphenyl)acetamide
CID 71828766
2-(4-acetamidoindol-1-yl)-N-cyclohexylacetamide
CID 71829005
2-(4-acetamidoindol-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 71828241
2-(4-acetamidoindol-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 71827899
2-[4-(2-methylpropanoylamino)indol-1-yl]acetic acid
CID 154846912
2-(4-acetamidoindol-1-yl)-N-[2-(furan-2-yl)ethyl]acetamide
CID 86207362
3-[(3S)-2,5-dioxo-3,4-dihydro-1H-1,4-benzodiazepin-3-yl]-N-[1-(2-methylpropyl)indol-4-yl]propanamide
CID 71825635
2-[(3S)-2,5-dioxo-3,4-dihydro-1H-1,4-benzodiazepin-3-yl]-N-[1-(2-methylpropyl)indol-4-yl]acetamide
CID 71825841
2-(4-acetamidoindol-1-yl)-N-(5,6,7,8-tetrahydro-4H-cyclohepta[d][1,3]thiazol-2-yl)acetamide
CID 71828066
N-[1-(2-methylpropyl)indol-4-yl]-4-methylsulfanyl-2-pyrrol-1-ylbutanamide
CID 121240638
2-(4-acetamidoindol-1-yl)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)acetamide
CID 71828007

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide?
The IUPAC name of 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide (CID 71827915) is 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide.
What is the SMILES notation for 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide?
The canonical SMILES for 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide is CC(=O)Nc1cccc2c1ccn2CC(=O)Nc1cccc2c1ccn2CC(C)C.
What is the InChIKey of 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide?
The InChIKey is SNXAWHZDIFCTBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N4O2/c1-16(2)14-27-12-10-19-21(7-5-8-22(19)27)26-24(30)15-28-13-11-18-20(25-17(3)29)6-4-9-23(18)28/h4-13,16H,14-15H2,1-3H3,(H,25,29)(H,26,30).
What are the key properties of 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide?
2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide has a molecular weight of 402.50 g/mol, XLogP of 4.85, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetamidoindol-1-yl)-N-[1-(2-methylpropyl)indol-4-yl]acetamide is sourced from PubChem (CID 71827915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).