1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine

C13H20N2O — CID 117200409

IUPAC1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine
SMILESCNC(C)CC1CNc2cccc(OC)c21
InChIInChI=1S/C13H20N2O/c1-9(14-2)7-10-8-15-11-5-4-6-12(16-3)13(10)11/h4-6,9-10,14-15H,7-8H2,1-3H3
InChIKeyAHLMCEWXRCSFNL-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.20
Rot. Bonds4

About 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine

1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine (PubChem CID 117200409) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine
PubChem CID117200409
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine
SMILESCNC(C)CC1CNc2cccc(OC)c21
InChIInChI=1S/C13H20N2O/c1-9(14-2)7-10-8-15-11-5-4-6-12(16-3)13(10)11/h4-6,9-10,14-15H,7-8H2,1-3H3
InChIKeyAHLMCEWXRCSFNL-UHFFFAOYSA-N
XLogP2.20
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxy-2,3-dihydro-1H-indol-3-yl)acetic acid
CID 82276657
4-amino-5-methoxy-1,2,3,4-tetrahydroquinolin-3-ol
CID 130137807
N-methyl-1-(5-methyl-2,3-dihydro-1H-indol-3-yl)propan-2-amine
CID 117201839
4-methoxy-2,3-dihydro-1H-indole-3-carboxylic acid
CID 82277350
N-methyl-1-[5-(trifluoromethyl)-2,3-dihydro-1H-indol-3-yl]propan-2-amine
CID 117201677
1-(2-bromo-3-methoxyphenyl)-N-methylpropan-2-amine
CID 84738148
3-ethyl-4-methylsulfanyl-2,3-dihydro-1H-indole
CID 83915674
5-methoxy-1,2,3,4-tetrahydroquinolin-4-ol
CID 130137804
2-methoxy-6-[2-(methylamino)propyl]phenol
CID 68884486
3-(4-bromo-2,3-dihydro-1H-indol-3-yl)-2-methylpropanoic acid
CID 117200016
3-(4-chloro-2,3-dihydro-1H-indol-3-yl)-2-methylpropanoic acid
CID 117200012
5-methoxy-4-methyl-3-propan-2-yl-2,3-dihydro-1H-quinoxaline
CID 84623748

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine?
The IUPAC name of 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine (CID 117200409) is 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine is CNC(C)CC1CNc2cccc(OC)c21.
What is the InChIKey of 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine?
The InChIKey is AHLMCEWXRCSFNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-9(14-2)7-10-8-15-11-5-4-6-12(16-3)13(10)11/h4-6,9-10,14-15H,7-8H2,1-3H3.
What are the key properties of 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine?
1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine has a molecular weight of 220.32 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-2,3-dihydro-1H-indol-3-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 117200409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).