4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide

C24H27N3O2 — CID 144760257

IUPAC4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide
SMILESCCC(=O)NC1CCC(N(C)C(=O)c2ccc(-c3ccc4[nH]ccc4c3)cc2)C1
InChIInChI=1S/C24H27N3O2/c1-3-23(28)26-20-9-10-21(15-20)27(2)24(29)17-6-4-16(5-7-17)18-8-11-22-19(14-18)12-13-25-22/h4-8,11-14,20-21,25H,3,9-10,15H2,1-2H3,(H,26,28)
InChIKeyNDTTZFFFAFTMIL-UHFFFAOYSA-N
MW389.50 g/mol
LogP4.35
Rot. Bonds5

About 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide

4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide (PubChem CID 144760257) has the molecular formula C24H27N3O2 and a molecular weight of 389.50 g/mol. Its IUPAC name is 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide.

Molecular Properties

Compound Name4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide
PubChem CID144760257
Molecular FormulaC24H27N3O2
Molecular Weight389.50 g/mol
Exact Mass389.21
IUPAC Name4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide
SMILESCCC(=O)NC1CCC(N(C)C(=O)c2ccc(-c3ccc4[nH]ccc4c3)cc2)C1
InChIInChI=1S/C24H27N3O2/c1-3-23(28)26-20-9-10-21(15-20)27(2)24(29)17-6-4-16(5-7-17)18-8-11-22-19(14-18)12-13-25-22/h4-8,11-14,20-21,25H,3,9-10,15H2,1-2H3,(H,26,28)
InChIKeyNDTTZFFFAFTMIL-UHFFFAOYSA-N
XLogP4.35
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.50
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide?
The IUPAC name of 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide (CID 144760257) is 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide.
What is the SMILES notation for 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide?
The canonical SMILES for 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide is CCC(=O)NC1CCC(N(C)C(=O)c2ccc(-c3ccc4[nH]ccc4c3)cc2)C1.
What is the InChIKey of 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide?
The InChIKey is NDTTZFFFAFTMIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2/c1-3-23(28)26-20-9-10-21(15-20)27(2)24(29)17-6-4-16(5-7-17)18-8-11-22-19(14-18)12-13-25-22/h4-8,11-14,20-21,25H,3,9-10,15H2,1-2H3,(H,26,28).
What are the key properties of 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide?
4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide has a molecular weight of 389.50 g/mol, XLogP of 4.35, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-indol-5-yl)-N-methyl-N-[3-(propanoylamino)cyclopentyl]benzamide is sourced from PubChem (CID 144760257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).