1-methyl-3-[2-(methylamino)propyl]indol-6-ol

C13H18N2O — CID 83917388

IUPAC1-methyl-3-[2-(methylamino)propyl]indol-6-ol
SMILESCNC(C)Cc1cn(C)c2cc(O)ccc12
InChIInChI=1S/C13H18N2O/c1-9(14-2)6-10-8-15(3)13-7-11(16)4-5-12(10)13/h4-5,7-9,14,16H,6H2,1-3H3
InChIKeyHQHNMAXUMZRILK-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.03
Rot. Bonds3

About 1-methyl-3-[2-(methylamino)propyl]indol-6-ol

1-methyl-3-[2-(methylamino)propyl]indol-6-ol (PubChem CID 83917388) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-methyl-3-[2-(methylamino)propyl]indol-6-ol.

Molecular Properties

Compound Name1-methyl-3-[2-(methylamino)propyl]indol-6-ol
PubChem CID83917388
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-methyl-3-[2-(methylamino)propyl]indol-6-ol
SMILESCNC(C)Cc1cn(C)c2cc(O)ccc12
InChIInChI=1S/C13H18N2O/c1-9(14-2)6-10-8-15(3)13-7-11(16)4-5-12(10)13/h4-5,7-9,14,16H,6H2,1-3H3
InChIKeyHQHNMAXUMZRILK-UHFFFAOYSA-N
XLogP2.03
TPSA37.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(methylamino)propyl]benzene-1,3-diol
CID 84732352
N-methyl-1-(6-methyl-1-propan-2-ylindol-3-yl)propan-2-amine
CID 117196206
3-(6-hydroxy-1-methylindol-3-yl)propanoic acid
CID 71537680
1-(1,3-dimethylindol-6-yl)-N-methylpropan-2-amine
CID 117205030
1,3-dimethylindol-6-ol
CID 83815731
1-(1-ethyl-6-methylindol-3-yl)-N-methylpropan-2-amine
CID 117196204
6-hydroxy-N,1-dimethylindole-3-carboxamide
CID 23572873
1-propan-2-yl-3-(propan-2-ylsulfanylmethyl)indol-6-ol
CID 117179103
1-propan-2-yl-3-[(propan-2-ylamino)methyl]indol-6-ol
CID 117179101
3-(2-fluoropropan-2-yl)-1-methylindol-6-ol
CID 84675129
1-(5-chloro-1-propan-2-ylindol-3-yl)-N-methylpropan-2-amine
CID 117195612
N-[1-(1-methylindol-3-yl)propan-2-yl]formamide
CID 166490360

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[2-(methylamino)propyl]indol-6-ol?
The IUPAC name of 1-methyl-3-[2-(methylamino)propyl]indol-6-ol (CID 83917388) is 1-methyl-3-[2-(methylamino)propyl]indol-6-ol.
What is the SMILES notation for 1-methyl-3-[2-(methylamino)propyl]indol-6-ol?
The canonical SMILES for 1-methyl-3-[2-(methylamino)propyl]indol-6-ol is CNC(C)Cc1cn(C)c2cc(O)ccc12.
What is the InChIKey of 1-methyl-3-[2-(methylamino)propyl]indol-6-ol?
The InChIKey is HQHNMAXUMZRILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9(14-2)6-10-8-15(3)13-7-11(16)4-5-12(10)13/h4-5,7-9,14,16H,6H2,1-3H3.
What are the key properties of 1-methyl-3-[2-(methylamino)propyl]indol-6-ol?
1-methyl-3-[2-(methylamino)propyl]indol-6-ol has a molecular weight of 218.30 g/mol, XLogP of 2.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[2-(methylamino)propyl]indol-6-ol is sourced from PubChem (CID 83917388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).