4-methoxy-2-(4-methoxyphenyl)-1H-indole

C16H15NO2 — CID 159214029

IUPAC4-methoxy-2-(4-methoxyphenyl)-1H-indole
SMILESCOc1ccc(-c2cc3c(OC)cccc3[nH]2)cc1
InChIInChI=1S/C16H15NO2/c1-18-12-8-6-11(7-9-12)15-10-13-14(17-15)4-3-5-16(13)19-2/h3-10,17H,1-2H3
InChIKeyKQVPDHNHOFPPPA-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.85
Rot. Bonds3

About 4-methoxy-2-(4-methoxyphenyl)-1H-indole

4-methoxy-2-(4-methoxyphenyl)-1H-indole (PubChem CID 159214029) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 4-methoxy-2-(4-methoxyphenyl)-1H-indole.

Molecular Properties

Compound Name4-methoxy-2-(4-methoxyphenyl)-1H-indole
PubChem CID159214029
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name4-methoxy-2-(4-methoxyphenyl)-1H-indole
SMILESCOc1ccc(-c2cc3c(OC)cccc3[nH]2)cc1
InChIInChI=1S/C16H15NO2/c1-18-12-8-6-11(7-9-12)15-10-13-14(17-15)4-3-5-16(13)19-2/h3-10,17H,1-2H3
InChIKeyKQVPDHNHOFPPPA-UHFFFAOYSA-N
XLogP3.85
TPSA34.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,9-dimethoxy-2-(4-methoxyphenyl)-1H-benzo[g]indole
CID 14387104
2-fluoro-4-methoxy-1H-indole
CID 174907936
4-methoxy-2-methyl-1H-indole;2-methyl-1H-indole
CID 159600634
4-butoxy-5-methoxy-2-phenyl-1H-indole
CID 71126141
4-methoxy-3-(4-methoxyphenyl)-2-methyl-1H-indole
CID 13415856
5,6-dimethoxy-2-phenyl-1H-indole
CID 4066504
2,3-bis(4-methoxyphenyl)-1H-indole
CID 21129
4-methoxy-1H-indole-2-carbonyl chloride
CID 53404354
7-chloro-2-(4-methoxyphenyl)-1H-indole
CID 131886896
N-hydroperoxy-4-methoxy-1H-indol-2-amine
CID 142093209
3-(4-methoxy-1H-indol-2-yl)-1,2-oxazole-5-carboxylic acid
CID 136985700
5-(4-methoxy-1H-indol-2-yl)-1H-pyrazole-4-carboxylic acid
CID 136986503

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(4-methoxyphenyl)-1H-indole?
The IUPAC name of 4-methoxy-2-(4-methoxyphenyl)-1H-indole (CID 159214029) is 4-methoxy-2-(4-methoxyphenyl)-1H-indole.
What is the SMILES notation for 4-methoxy-2-(4-methoxyphenyl)-1H-indole?
The canonical SMILES for 4-methoxy-2-(4-methoxyphenyl)-1H-indole is COc1ccc(-c2cc3c(OC)cccc3[nH]2)cc1.
What is the InChIKey of 4-methoxy-2-(4-methoxyphenyl)-1H-indole?
The InChIKey is KQVPDHNHOFPPPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-18-12-8-6-11(7-9-12)15-10-13-14(17-15)4-3-5-16(13)19-2/h3-10,17H,1-2H3.
What are the key properties of 4-methoxy-2-(4-methoxyphenyl)-1H-indole?
4-methoxy-2-(4-methoxyphenyl)-1H-indole has a molecular weight of 253.30 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(4-methoxyphenyl)-1H-indole is sourced from PubChem (CID 159214029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).