2-(2-aminopropan-2-yl)-1-ethylindol-5-ol

C13H18N2O — CID 117121687

IUPAC2-(2-aminopropan-2-yl)-1-ethylindol-5-ol
SMILESCCn1c(C(C)(C)N)cc2cc(O)ccc21
InChIInChI=1S/C13H18N2O/c1-4-15-11-6-5-10(16)7-9(11)8-12(15)13(2,3)14/h5-8,16H,4,14H2,1-3H3
InChIKeySUNPCCYUGDZQRA-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.56
Rot. Bonds2

About 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol

2-(2-aminopropan-2-yl)-1-ethylindol-5-ol (PubChem CID 117121687) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol.

Molecular Properties

Compound Name2-(2-aminopropan-2-yl)-1-ethylindol-5-ol
PubChem CID117121687
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-(2-aminopropan-2-yl)-1-ethylindol-5-ol
SMILESCCn1c(C(C)(C)N)cc2cc(O)ccc21
InChIInChI=1S/C13H18N2O/c1-4-15-11-6-5-10(16)7-9(11)8-12(15)13(2,3)14/h5-8,16H,4,14H2,1-3H3
InChIKeySUNPCCYUGDZQRA-UHFFFAOYSA-N
XLogP2.56
TPSA51.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-ethyl-5-(trifluoromethyl)indol-2-yl]propan-2-amine
CID 117121445
1-ethyl-2-methylindol-5-ol
CID 115014527
1-ethyl-2-(methylsulfonylmethyl)indol-5-ol
CID 117177179
1-ethyl-2-(methoxymethyl)indol-5-ol
CID 117177336
2-(4-aminophenyl)-1-ethylindol-5-ol
CID 143184820
2-(1-ethyl-6-hydroxyindol-2-yl)-2-methylpropanoic acid
CID 117122945
9-ethyl-1-methylcarbazole-3,6-diol
CID 69337155
2-(1-ethyl-6-methylindol-2-yl)propan-2-ol
CID 117122681
2-(5-tert-butyl-1-methylindol-2-yl)propan-2-amine
CID 84631643
4-[(1-ethyl-5-methylindol-2-yl)methoxy]phenol
CID 117185480
O-[(5-bromo-1-ethylindol-2-yl)methyl]hydroxylamine
CID 117195269
1-ethyl-5-hydroxy-3-methylindole-2-carboxylic acid
CID 105473665

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol?
The IUPAC name of 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol (CID 117121687) is 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol.
What is the SMILES notation for 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol?
The canonical SMILES for 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol is CCn1c(C(C)(C)N)cc2cc(O)ccc21.
What is the InChIKey of 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol?
The InChIKey is SUNPCCYUGDZQRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-4-15-11-6-5-10(16)7-9(11)8-12(15)13(2,3)14/h5-8,16H,4,14H2,1-3H3.
What are the key properties of 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol?
2-(2-aminopropan-2-yl)-1-ethylindol-5-ol has a molecular weight of 218.30 g/mol, XLogP of 2.56, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopropan-2-yl)-1-ethylindol-5-ol is sourced from PubChem (CID 117121687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).