2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine

C23H30N2O — CID 10712859

IUPAC2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine
SMILESCOc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2c(c1)CCN2
InChIInChI=1S/C23H30N2O/c1-25(14-12-17-9-10-22-18(15-17)11-13-24-22)16-19-5-3-7-21-20(19)6-4-8-23(21)26-2/h4,6,8-10,15,19,24H,3,5,7,11-14,16H2,1-2H3/t19-/m0/s1
InChIKeyGCBWWAZZKWFUJJ-IBGZPJMESA-N
MW350.51 g/mol
LogP4.26
Rot. Bonds6

About 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine

2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine (PubChem CID 10712859) has the molecular formula C23H30N2O and a molecular weight of 350.51 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine
PubChem CID10712859
Molecular FormulaC23H30N2O
Molecular Weight350.51 g/mol
Exact Mass350.24
IUPAC Name2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine
SMILESCOc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2c(c1)CCN2
InChIInChI=1S/C23H30N2O/c1-25(14-12-17-9-10-22-18(15-17)11-13-24-22)16-19-5-3-7-21-20(19)6-4-8-23(21)26-2/h4,6,8-10,15,19,24H,3,5,7,11-14,16H2,1-2H3/t19-/m0/s1
InChIKeyGCBWWAZZKWFUJJ-IBGZPJMESA-N
XLogP4.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.51
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine?
The IUPAC name of 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine (CID 10712859) is 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine is COc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2c(c1)CCN2.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine?
The InChIKey is GCBWWAZZKWFUJJ-IBGZPJMESA-N. The full InChI is InChI=1S/C23H30N2O/c1-25(14-12-17-9-10-22-18(15-17)11-13-24-22)16-19-5-3-7-21-20(19)6-4-8-23(21)26-2/h4,6,8-10,15,19,24H,3,5,7,11-14,16H2,1-2H3/t19-/m0/s1.
What are the key properties of 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine?
2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine has a molecular weight of 350.51 g/mol, XLogP of 4.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-5-yl)-N-[[(1R)-5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]methyl]-N-methylethanamine is sourced from PubChem (CID 10712859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).