(7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone

C19H16N2O2 — CID 11616461

IUPAC(7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone
SMILESCCc1cccc2cc(C(=O)c3cc4cc(O)ccc4[nH]3)[nH]c12
InChIInChI=1S/C19H16N2O2/c1-2-11-4-3-5-12-9-17(21-18(11)12)19(23)16-10-13-8-14(22)6-7-15(13)20-16/h3-10,20-22H,2H2,1H3
InChIKeyHGCKYXAAMVCWOL-UHFFFAOYSA-N
MW304.35 g/mol
LogP4.15
Rot. Bonds3

About (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone

(7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone (PubChem CID 11616461) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone.

Molecular Properties

Compound Name(7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone
PubChem CID11616461
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name(7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone
SMILESCCc1cccc2cc(C(=O)c3cc4cc(O)ccc4[nH]3)[nH]c12
InChIInChI=1S/C19H16N2O2/c1-2-11-4-3-5-12-9-17(21-18(11)12)19(23)16-10-13-8-14(22)6-7-15(13)20-16/h3-10,20-22H,2H2,1H3
InChIKeyHGCKYXAAMVCWOL-UHFFFAOYSA-N
XLogP4.15
TPSA68.88 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
The IUPAC name of (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone (CID 11616461) is (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone.
What is the SMILES notation for (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
The canonical SMILES for (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone is CCc1cccc2cc(C(=O)c3cc4cc(O)ccc4[nH]3)[nH]c12.
What is the InChIKey of (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
The InChIKey is HGCKYXAAMVCWOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-2-11-4-3-5-12-9-17(21-18(11)12)19(23)16-10-13-8-14(22)6-7-15(13)20-16/h3-10,20-22H,2H2,1H3.
What are the key properties of (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone?
(7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone has a molecular weight of 304.35 g/mol, XLogP of 4.15, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethyl-1H-indol-2-yl)-(5-hydroxy-1H-indol-2-yl)methanone is sourced from PubChem (CID 11616461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).