1-methyl-2-[2-(methylamino)ethyl]indol-7-ol

C12H16N2O — CID 117197124

IUPAC1-methyl-2-[2-(methylamino)ethyl]indol-7-ol
SMILESCNCCc1cc2cccc(O)c2n1C
InChIInChI=1S/C12H16N2O/c1-13-7-6-10-8-9-4-3-5-11(15)12(9)14(10)2/h3-5,8,13,15H,6-7H2,1-2H3
InChIKeyQMVDQEMPXLKZMA-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.65
Rot. Bonds3

About 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol

1-methyl-2-[2-(methylamino)ethyl]indol-7-ol (PubChem CID 117197124) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol.

Molecular Properties

Compound Name1-methyl-2-[2-(methylamino)ethyl]indol-7-ol
PubChem CID117197124
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name1-methyl-2-[2-(methylamino)ethyl]indol-7-ol
SMILESCNCCc1cc2cccc(O)c2n1C
InChIInChI=1S/C12H16N2O/c1-13-7-6-10-8-9-4-3-5-11(15)12(9)14(10)2/h3-5,8,13,15H,6-7H2,1-2H3
InChIKeyQMVDQEMPXLKZMA-UHFFFAOYSA-N
XLogP1.65
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(1,6,7-trimethylindol-2-yl)ethanamine
CID 84622439
2-[1-ethyl-7-(trifluoromethyl)indol-2-yl]-N-methylethanamine
CID 117196600
2-(7-methoxy-1,5-dimethylindol-2-yl)-N-methylethanamine
CID 84627085
1-methyl-2-[3-(methylamino)propyl]indol-5-ol
CID 117195354
N-[(7-bromo-1-methylindol-2-yl)methyl]hydroxylamine
CID 82665313
N-[(1,7-dimethylindol-2-yl)methyl]ethanamine
CID 117186537
N-methyl-3-[1-propan-2-yl-7-(trifluoromethyl)indol-2-yl]propan-1-amine
CID 117196610
2-ethyl-7-methoxy-1-methylindole
CID 84662166
2-(4-chloro-7-methoxy-1-methylindol-2-yl)-N-methylethanamine
CID 84634780
3-[1-methyl-7-(trifluoromethyl)indol-2-yl]propan-1-amine
CID 83919994
2-(aminooxymethyl)-1-propan-2-ylindol-7-ol
CID 117197178
2-(7-hydroxy-1-propan-2-ylindol-2-yl)acetic acid
CID 117197220

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol?
The IUPAC name of 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol (CID 117197124) is 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol.
What is the SMILES notation for 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol?
The canonical SMILES for 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol is CNCCc1cc2cccc(O)c2n1C.
What is the InChIKey of 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol?
The InChIKey is QMVDQEMPXLKZMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-13-7-6-10-8-9-4-3-5-11(15)12(9)14(10)2/h3-5,8,13,15H,6-7H2,1-2H3.
What are the key properties of 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol?
1-methyl-2-[2-(methylamino)ethyl]indol-7-ol has a molecular weight of 204.27 g/mol, XLogP of 1.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[2-(methylamino)ethyl]indol-7-ol is sourced from PubChem (CID 117197124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).