2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline

C19H20N2O — CID 59936471

IUPAC2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOC1c2ccccc2NC(c2c[nH]c3ccccc23)C1C
InChIInChI=1S/C19H20N2O/c1-12-18(15-11-20-16-9-5-3-7-13(15)16)21-17-10-6-4-8-14(17)19(12)22-2/h3-12,18-21H,1-2H3
InChIKeyDAZMZFCNAIQIOO-UHFFFAOYSA-N
MW292.38 g/mol
LogP4.66
Rot. Bonds2

About 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline

2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline (PubChem CID 59936471) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline
PubChem CID59936471
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline
SMILESCOC1c2ccccc2NC(c2c[nH]c3ccccc23)C1C
InChIInChI=1S/C19H20N2O/c1-12-18(15-11-20-16-9-5-3-7-13(15)16)21-17-10-6-4-8-14(17)19(12)22-2/h3-12,18-21H,1-2H3
InChIKeyDAZMZFCNAIQIOO-UHFFFAOYSA-N
XLogP4.66
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-methylpiperazin-2-yl)-1H-indole
CID 116829242
ethane;3-piperidin-4-yl-1H-indole
CID 91036207
methyl (2S,3S)-2-(1H-indol-3-yl)-4-(trifluoromethyl)-2,3-dihydro-1H-1,5-benzodiazepine-3-carboxylate
CID 135003337
methane;3-piperidin-4-yl-1H-indole
CID 70444570
(6R,6aS)-3-hydroxy-6-(1H-indol-3-yl)-2-methoxy-5,6,6a,7,8,9-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-11-one
CID 10021606
4-(1H-indol-3-yl)-8-phenoxy-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
CID 17242496
5-bromo-3-(5-bromo-3-methyl-2,3-dihydro-1H-indol-2-yl)-1H-indole
CID 123956330
3-(1-methylpiperidin-4-yl)-1H-indole;dihydrochloride
CID 174560357
3-(1H-indol-3-yl)oxiran-2-ol
CID 123804780
4-(1H-indol-3-yl)azetidin-2-one
CID 55255346
2-(1H-indol-3-yl)-3-propan-2-yl-1,2-dihydroquinazolin-4-one
CID 54777929
2-(1H-indol-3-yl)-4H-1,4-benzothiazin-3-one
CID 4794447

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline (CID 59936471) is 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline is COC1c2ccccc2NC(c2c[nH]c3ccccc23)C1C.
What is the InChIKey of 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is DAZMZFCNAIQIOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-12-18(15-11-20-16-9-5-3-7-13(15)16)21-17-10-6-4-8-14(17)19(12)22-2/h3-12,18-21H,1-2H3.
What are the key properties of 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline?
2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 292.38 g/mol, XLogP of 4.66, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-4-methoxy-3-methyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 59936471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).