5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide

C23H23N3O3 — CID 164624533

IUPAC5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide
SMILESO=C(NCC1CCNCC1)c1c[nH]c2cc(-c3ccoc3)c(-c3ccoc3)cc12
InChIInChI=1S/C23H23N3O3/c27-23(26-11-15-1-5-24-6-2-15)21-12-25-22-10-19(17-4-8-29-14-17)18(9-20(21)22)16-3-7-28-13-16/h3-4,7-10,12-15,24-25H,1-2,5-6,11H2,(H,26,27)
InChIKeyMTNYECYMGPDZLX-UHFFFAOYSA-N
MW389.46 g/mol
LogP4.42
Rot. Bonds5

About 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide

5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide (PubChem CID 164624533) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide
PubChem CID164624533
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide
SMILESO=C(NCC1CCNCC1)c1c[nH]c2cc(-c3ccoc3)c(-c3ccoc3)cc12
InChIInChI=1S/C23H23N3O3/c27-23(26-11-15-1-5-24-6-2-15)21-12-25-22-10-19(17-4-8-29-14-17)18(9-20(21)22)16-3-7-28-13-16/h3-4,7-10,12-15,24-25H,1-2,5-6,11H2,(H,26,27)
InChIKeyMTNYECYMGPDZLX-UHFFFAOYSA-N
XLogP4.42
TPSA83.20 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 54.42
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide?
The IUPAC name of 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide (CID 164624533) is 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide?
The canonical SMILES for 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide is O=C(NCC1CCNCC1)c1c[nH]c2cc(-c3ccoc3)c(-c3ccoc3)cc12.
What is the InChIKey of 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide?
The InChIKey is MTNYECYMGPDZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c27-23(26-11-15-1-5-24-6-2-15)21-12-25-22-10-19(17-4-8-29-14-17)18(9-20(21)22)16-3-7-28-13-16/h3-4,7-10,12-15,24-25H,1-2,5-6,11H2,(H,26,27).
What are the key properties of 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide?
5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 4.42, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-bis(furan-3-yl)-N-(piperidin-4-ylmethyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 164624533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).