2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol

C13H18N2O — CID 83535139

IUPAC2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol
SMILESCc1c(C(C)(N)CO)c2ccccc2n1C
InChIInChI=1S/C13H18N2O/c1-9-12(13(2,14)8-16)10-6-4-5-7-11(10)15(9)3/h4-7,16H,8,14H2,1-3H3
InChIKeyBELGGSRFCFDKDL-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.65
Rot. Bonds2

About 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol

2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol (PubChem CID 83535139) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol.

Molecular Properties

Compound Name2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol
PubChem CID83535139
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol
SMILESCc1c(C(C)(N)CO)c2ccccc2n1C
InChIInChI=1S/C13H18N2O/c1-9-12(13(2,14)8-16)10-6-4-5-7-11(10)15(9)3/h4-7,16H,8,14H2,1-3H3
InChIKeyBELGGSRFCFDKDL-UHFFFAOYSA-N
XLogP1.65
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 ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,2-dimethylindol-3-yl)acetamide
CID 67627690
N-[(1,2-dimethylindol-3-yl)methyl]-2,2-dimethylpropanamide
CID 110782396
ethane;1,2,3-trimethylindole
CID 91590745
(1R)-2-amino-1-(1,2-dimethylindol-3-yl)ethanol
CID 95438701
[2-(1,2-dimethylindol-3-yl)phenyl]methanol
CID 143270609
2-[(1,2-dimethylindol-3-yl)methylamino]propan-1-ol
CID 82475346
3-iodo-1,2-dimethylindole
CID 19093282
3-amino-4-(1,2-dimethylindol-3-yl)but-1-en-2-ol;ethane
CID 153346442
2-(1,2-dimethyl-4-oxoquinolin-3-yl)acetic acid
CID 82242835
N'-amino-1,2-dimethylindole-3-carboximidamide
CID 83532039
ethane;tris(ethane-1,1-diol);tris(1,2,3-trimethylindole)
CID 160660144
1-methyl-3-(2-methylpropyl)indole-2-carboxamide
CID 173435951

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol?
The IUPAC name of 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol (CID 83535139) is 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol.
What is the SMILES notation for 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol?
The canonical SMILES for 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol is Cc1c(C(C)(N)CO)c2ccccc2n1C.
What is the InChIKey of 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol?
The InChIKey is BELGGSRFCFDKDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9-12(13(2,14)8-16)10-6-4-5-7-11(10)15(9)3/h4-7,16H,8,14H2,1-3H3.
What are the key properties of 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol?
2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol has a molecular weight of 218.30 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(1,2-dimethylindol-3-yl)propan-1-ol is sourced from PubChem (CID 83535139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).