2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane

C14H22N2O — CID 143481750

IUPAC2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane
SMILESCC.Cn1c(CC(N)CO)cc2ccccc21
InChIInChI=1S/C12H16N2O.C2H6/c1-14-11(7-10(13)8-15)6-9-4-2-3-5-12(9)14;1-2/h2-6,10,15H,7-8,13H2,1H3;1-2H3
InChIKeyGUFPUMIONMWTIX-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.07
Rot. Bonds3

About 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane

2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane (PubChem CID 143481750) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane.

Molecular Properties

Compound Name2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane
PubChem CID143481750
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane
SMILESCC.Cn1c(CC(N)CO)cc2ccccc21
InChIInChI=1S/C12H16N2O.C2H6/c1-14-11(7-10(13)8-15)6-9-4-2-3-5-12(9)14;1-2/h2-6,10,15H,7-8,13H2,1H3;1-2H3
InChIKeyGUFPUMIONMWTIX-UHFFFAOYSA-N
XLogP2.07
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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2-amino-3-(1-methylbenzimidazol-2-yl)propan-1-ol;hydrochloride
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1-methyl-2-propylindole
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N-(1-hydroxy-2-methylpropan-2-yl)-2-(1-methylindol-2-yl)acetamide
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N-methyl-2-(1-methylindol-2-yl)acetamide
CID 139935396
1-(1-methylindol-2-yl)-3-[4-(2-methylpropyl)phenyl]butan-2-one
CID 175586016
2-amino-3-(2-chloro-1-methylindol-3-yl)propan-1-ol;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane?
The IUPAC name of 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane (CID 143481750) is 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane.
What is the SMILES notation for 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane?
The canonical SMILES for 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane is CC.Cn1c(CC(N)CO)cc2ccccc21.
What is the InChIKey of 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane?
The InChIKey is GUFPUMIONMWTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O.C2H6/c1-14-11(7-10(13)8-15)6-9-4-2-3-5-12(9)14;1-2/h2-6,10,15H,7-8,13H2,1H3;1-2H3.
What are the key properties of 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane?
2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane has a molecular weight of 234.34 g/mol, XLogP of 2.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(1-methylindol-2-yl)propan-1-ol;ethane is sourced from PubChem (CID 143481750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).