2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide

C24H18N4O2 — CID 72735772

IUPAC2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide
SMILESNC(=O)c1ccc2cc(-c3ccc(-c4cc5ccc(C(N)=O)cc5[nH]4)cc3)[nH]c2c1
InChIInChI=1S/C24H18N4O2/c25-23(29)17-7-5-15-9-19(27-21(15)11-17)13-1-2-14(4-3-13)20-10-16-6-8-18(24(26)30)12-22(16)28-20/h1-12,27-28H,(H2,25,29)(H2,26,30)
InChIKeyGIISALXUTCRBCE-UHFFFAOYSA-N
MW394.43 g/mol
LogP4.18
Rot. Bonds4

About 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide

2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide (PubChem CID 72735772) has the molecular formula C24H18N4O2 and a molecular weight of 394.43 g/mol. Its IUPAC name is 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide.

Molecular Properties

Compound Name2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide
PubChem CID72735772
Molecular FormulaC24H18N4O2
Molecular Weight394.43 g/mol
Exact Mass394.14
IUPAC Name2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide
SMILESNC(=O)c1ccc2cc(-c3ccc(-c4cc5ccc(C(N)=O)cc5[nH]4)cc3)[nH]c2c1
InChIInChI=1S/C24H18N4O2/c25-23(29)17-7-5-15-9-19(27-21(15)11-17)13-1-2-14(4-3-13)20-10-16-6-8-18(24(26)30)12-22(16)28-20/h1-12,27-28H,(H2,25,29)(H2,26,30)
InChIKeyGIISALXUTCRBCE-UHFFFAOYSA-N
XLogP4.18
TPSA117.76 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.43
LogP ≤ 54.18
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide?
The IUPAC name of 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide (CID 72735772) is 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide.
What is the SMILES notation for 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide?
The canonical SMILES for 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide is NC(=O)c1ccc2cc(-c3ccc(-c4cc5ccc(C(N)=O)cc5[nH]4)cc3)[nH]c2c1.
What is the InChIKey of 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide?
The InChIKey is GIISALXUTCRBCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18N4O2/c25-23(29)17-7-5-15-9-19(27-21(15)11-17)13-1-2-14(4-3-13)20-10-16-6-8-18(24(26)30)12-22(16)28-20/h1-12,27-28H,(H2,25,29)(H2,26,30).
What are the key properties of 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide?
2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide has a molecular weight of 394.43 g/mol, XLogP of 4.18, 4 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(6-carbamoyl-1H-indol-2-yl)phenyl]-1H-indole-6-carboxamide is sourced from PubChem (CID 72735772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).