2-(1-hydroxy-2-methylindol-3-yl)ethanamine

C11H14N2O — CID 174625150

IUPAC2-(1-hydroxy-2-methylindol-3-yl)ethanamine
SMILESCc1c(CCN)c2ccccc2n1O
InChIInChI=1S/C11H14N2O/c1-8-9(6-7-12)10-4-2-3-5-11(10)13(8)14/h2-5,14H,6-7,12H2,1H3
InChIKeyOSESGYYRQCGJKF-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.69
Rot. Bonds2

About 2-(1-hydroxy-2-methylindol-3-yl)ethanamine

2-(1-hydroxy-2-methylindol-3-yl)ethanamine (PubChem CID 174625150) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-(1-hydroxy-2-methylindol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(1-hydroxy-2-methylindol-3-yl)ethanamine
PubChem CID174625150
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-(1-hydroxy-2-methylindol-3-yl)ethanamine
SMILESCc1c(CCN)c2ccccc2n1O
InChIInChI=1S/C11H14N2O/c1-8-9(6-7-12)10-4-2-3-5-11(10)13(8)14/h2-5,14H,6-7,12H2,1H3
InChIKeyOSESGYYRQCGJKF-UHFFFAOYSA-N
XLogP1.69
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-hydroxyl_pyridine', 'substructure': 'N/A'}

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Related Compounds

CID 163999461
CID 163999461
2-(2-methyl-1-phenylindol-3-yl)ethanamine
CID 744625
2-[3-(2-aminoethyl)-2-methylindol-1-yl]acetamide
CID 54594673
3-[(4-chlorophenyl)methyl]-1-hydroxy-2-methylquinolin-4-one
CID 171484515
[3-(2-aminoethyl)-2-methylindol-1-yl]-(1H-indol-7-yl)methanone
CID 112529811
ethane;9-hydroxycarbazole
CID 153391260
[3-(2-aminoethyl)-2-methylindol-1-yl]-(1-methylindol-5-yl)methanone
CID 112529805
3-[1-(2-methoxyethyl)-2-methylindol-3-yl]propan-1-amine
CID 170868097
3-[1-[(2-fluorophenyl)methyl]-2-methylindol-3-yl]propan-1-amine
CID 170878721
1-hydroxy-3-[(4-methoxyphenyl)methyl]-2-methylquinolin-4-one
CID 171484531
1-hydroxy-2-methyl-3-[(4-nitrophenyl)methyl]quinolin-4-one
CID 171484516
2-(2-methyl-1-prop-2-enylindol-3-yl)ethanol
CID 50923194

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxy-2-methylindol-3-yl)ethanamine?
The IUPAC name of 2-(1-hydroxy-2-methylindol-3-yl)ethanamine (CID 174625150) is 2-(1-hydroxy-2-methylindol-3-yl)ethanamine.
What is the SMILES notation for 2-(1-hydroxy-2-methylindol-3-yl)ethanamine?
The canonical SMILES for 2-(1-hydroxy-2-methylindol-3-yl)ethanamine is Cc1c(CCN)c2ccccc2n1O.
What is the InChIKey of 2-(1-hydroxy-2-methylindol-3-yl)ethanamine?
The InChIKey is OSESGYYRQCGJKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-8-9(6-7-12)10-4-2-3-5-11(10)13(8)14/h2-5,14H,6-7,12H2,1H3.
What are the key properties of 2-(1-hydroxy-2-methylindol-3-yl)ethanamine?
2-(1-hydroxy-2-methylindol-3-yl)ethanamine has a molecular weight of 190.25 g/mol, XLogP of 1.69, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxy-2-methylindol-3-yl)ethanamine is sourced from PubChem (CID 174625150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).