2-[6-(methylaminomethyl)indol-1-yl]ethanol

C12H16N2O — CID 102916522

IUPAC2-[6-(methylaminomethyl)indol-1-yl]ethanol
SMILESCNCc1ccc2ccn(CCO)c2c1
InChIInChI=1S/C12H16N2O/c1-13-9-10-2-3-11-4-5-14(6-7-15)12(11)8-10/h2-5,8,13,15H,6-7,9H2,1H3
InChIKeyLVQOFBMSQPYHFC-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.35
Rot. Bonds4

About 2-[6-(methylaminomethyl)indol-1-yl]ethanol

2-[6-(methylaminomethyl)indol-1-yl]ethanol (PubChem CID 102916522) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-[6-(methylaminomethyl)indol-1-yl]ethanol.

Molecular Properties

Compound Name2-[6-(methylaminomethyl)indol-1-yl]ethanol
PubChem CID102916522
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-[6-(methylaminomethyl)indol-1-yl]ethanol
SMILESCNCc1ccc2ccn(CCO)c2c1
InChIInChI=1S/C12H16N2O/c1-13-9-10-2-3-11-4-5-14(6-7-15)12(11)8-10/h2-5,8,13,15H,6-7,9H2,1H3
InChIKeyLVQOFBMSQPYHFC-UHFFFAOYSA-N
XLogP1.35
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-[1-(3-methylbut-3-enyl)indol-6-yl]methanamine
CID 114477146
1-(1-hept-6-enylindol-6-yl)-N-methylmethanamine
CID 107010398
1-[1-(2-ethylbutyl)indol-6-yl]-N-methylmethanamine
CID 82924593
N-methyl-1-[1-(2-pyridin-2-ylethyl)indol-6-yl]methanamine
CID 102916586
2-[5-(ethylaminomethyl)indol-1-yl]ethanol
CID 102915827
1-[1-[(3,4-difluorophenyl)methyl]indol-6-yl]-N-methylmethanamine
CID 82926342
N-methyl-1-[1-[(3-methylimidazol-4-yl)methyl]indol-6-yl]methanamine
CID 102916641
2-[6-(methylaminomethyl)indol-1-yl]-1-piperidin-1-ylethanone
CID 102916558
3-[6-(aminomethyl)indol-1-yl]propan-1-ol
CID 102916381
N-methyl-1-[1-(1,2,4-oxadiazol-3-ylmethyl)indol-6-yl]methanamine
CID 102916629
4-[6-[(tert-butylamino)methyl]indol-1-yl]-2-methylbutan-2-ol
CID 102916956
2-(5,6-dimethylindol-1-yl)ethanol
CID 83944319

Frequently Asked Questions

What is the IUPAC name of 2-[6-(methylaminomethyl)indol-1-yl]ethanol?
The IUPAC name of 2-[6-(methylaminomethyl)indol-1-yl]ethanol (CID 102916522) is 2-[6-(methylaminomethyl)indol-1-yl]ethanol.
What is the SMILES notation for 2-[6-(methylaminomethyl)indol-1-yl]ethanol?
The canonical SMILES for 2-[6-(methylaminomethyl)indol-1-yl]ethanol is CNCc1ccc2ccn(CCO)c2c1.
What is the InChIKey of 2-[6-(methylaminomethyl)indol-1-yl]ethanol?
The InChIKey is LVQOFBMSQPYHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-13-9-10-2-3-11-4-5-14(6-7-15)12(11)8-10/h2-5,8,13,15H,6-7,9H2,1H3.
What are the key properties of 2-[6-(methylaminomethyl)indol-1-yl]ethanol?
2-[6-(methylaminomethyl)indol-1-yl]ethanol has a molecular weight of 204.27 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(methylaminomethyl)indol-1-yl]ethanol is sourced from PubChem (CID 102916522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).