3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol

C18H16N2O — CID 15933689

IUPAC3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol
SMILESCc1c(-c2ccc(O)c3[nH]cc(C)c23)[nH]c2ccccc12
InChIInChI=1S/C18H16N2O/c1-10-9-19-18-15(21)8-7-13(16(10)18)17-11(2)12-5-3-4-6-14(12)20-17/h3-9,19-21H,1-2H3
InChIKeyVUKPSNZUQOVNKN-UHFFFAOYSA-N
MW276.34 g/mol
LogP4.64
Rot. Bonds1

About 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol

3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol (PubChem CID 15933689) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol.

Molecular Properties

Compound Name3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol
PubChem CID15933689
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol
SMILESCc1c(-c2ccc(O)c3[nH]cc(C)c23)[nH]c2ccccc12
InChIInChI=1S/C18H16N2O/c1-10-9-19-18-15(21)8-7-13(16(10)18)17-11(2)12-5-3-4-6-14(12)20-17/h3-9,19-21H,1-2H3
InChIKeyVUKPSNZUQOVNKN-UHFFFAOYSA-N
XLogP4.64
TPSA51.81 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol?
The IUPAC name of 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol (CID 15933689) is 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol.
What is the SMILES notation for 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol?
The canonical SMILES for 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol is Cc1c(-c2ccc(O)c3[nH]cc(C)c23)[nH]c2ccccc12.
What is the InChIKey of 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol?
The InChIKey is VUKPSNZUQOVNKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c1-10-9-19-18-15(21)8-7-13(16(10)18)17-11(2)12-5-3-4-6-14(12)20-17/h3-9,19-21H,1-2H3.
What are the key properties of 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol?
3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol has a molecular weight of 276.34 g/mol, XLogP of 4.64, 1 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(3-methyl-1H-indol-2-yl)-1H-indol-7-ol is sourced from PubChem (CID 15933689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).