5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide

C24H24N4O3 — CID 83273417

IUPAC5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide
SMILESCCCn1c(C(=O)NCCc2ccccn2)cc2cc(NC(=O)c3ccco3)ccc21
InChIInChI=1S/C24H24N4O3/c1-2-13-28-20-9-8-19(27-24(30)22-7-5-14-31-22)15-17(20)16-21(28)23(29)26-12-10-18-6-3-4-11-25-18/h3-9,11,14-16H,2,10,12-13H2,1H3,(H,26,29)(H,27,30)
InChIKeyFLQVYZYMGUVUOU-UHFFFAOYSA-N
MW416.48 g/mol
LogP4.26
Rot. Bonds8

About 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide

5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide (PubChem CID 83273417) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide.

Molecular Properties

Compound Name5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide
PubChem CID83273417
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC Name5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide
SMILESCCCn1c(C(=O)NCCc2ccccn2)cc2cc(NC(=O)c3ccco3)ccc21
InChIInChI=1S/C24H24N4O3/c1-2-13-28-20-9-8-19(27-24(30)22-7-5-14-31-22)15-17(20)16-21(28)23(29)26-12-10-18-6-3-4-11-25-18/h3-9,11,14-16H,2,10,12-13H2,1H3,(H,26,29)(H,27,30)
InChIKeyFLQVYZYMGUVUOU-UHFFFAOYSA-N
XLogP4.26
TPSA89.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide?
The IUPAC name of 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide (CID 83273417) is 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide.
What is the SMILES notation for 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide?
The canonical SMILES for 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide is CCCn1c(C(=O)NCCc2ccccn2)cc2cc(NC(=O)c3ccco3)ccc21.
What is the InChIKey of 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide?
The InChIKey is FLQVYZYMGUVUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3/c1-2-13-28-20-9-8-19(27-24(30)22-7-5-14-31-22)15-17(20)16-21(28)23(29)26-12-10-18-6-3-4-11-25-18/h3-9,11,14-16H,2,10,12-13H2,1H3,(H,26,29)(H,27,30).
What are the key properties of 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide?
5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide has a molecular weight of 416.48 g/mol, XLogP of 4.26, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-carbonylamino)-1-propyl-N-(2-pyridin-2-ylethyl)indole-2-carboxamide is sourced from PubChem (CID 83273417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).