1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine

C13H18N2O — CID 84622943

IUPAC1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine
SMILESCNCc1cc2cc(OC)cc(C)c2n1C
InChIInChI=1S/C13H18N2O/c1-9-5-12(16-4)7-10-6-11(8-14-2)15(3)13(9)10/h5-7,14H,8H2,1-4H3
InChIKeyAVEZAHHLRKDGLM-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.21
Rot. Bonds3

About 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine

1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine (PubChem CID 84622943) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine
PubChem CID84622943
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine
SMILESCNCc1cc2cc(OC)cc(C)c2n1C
InChIInChI=1S/C13H18N2O/c1-9-5-12(16-4)7-10-6-11(8-14-2)15(3)13(9)10/h5-7,14H,8H2,1-4H3
InChIKeyAVEZAHHLRKDGLM-UHFFFAOYSA-N
XLogP2.21
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methoxy-1,7-dimethylindole-2-carbaldehyde
CID 105455211
4-methoxy-2-methyl-6-(methylaminomethyl)phenol
CID 84657983
5-methoxy-1,7-dimethyl-2-pyrrolidin-2-ylindole
CID 84631519
2-(7-methoxy-1,5-dimethylindol-2-yl)-N-methylethanamine
CID 84627085
1-(5-methoxy-1-propan-2-ylindol-2-yl)-N-methylmethanamine
CID 83860149
1-(5-methoxy-2,7-dimethyl-1H-indol-3-yl)-N-methylmethanamine
CID 82493658
1-(3,5-dimethoxy-2-methylphenyl)-N-methylmethanamine
CID 84666309
1-(6,8-dimethoxy-2-methylquinolin-3-yl)-N-methylmethanamine
CID 82244248
N-[(1,7-dimethylindol-2-yl)methyl]ethanamine
CID 117186537
5-methoxy-1-(methoxymethyl)-7-methyl-2-prop-1-en-2-ylindole
CID 86052830
N-[(1,6,7-trimethylindol-2-yl)methyl]propan-2-amine
CID 84626388
1-(4,6-dimethoxy-2-pyridinyl)-N-methylmethanamine
CID 84658512

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine?
The IUPAC name of 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine (CID 84622943) is 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine?
The canonical SMILES for 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine is CNCc1cc2cc(OC)cc(C)c2n1C.
What is the InChIKey of 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine?
The InChIKey is AVEZAHHLRKDGLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9-5-12(16-4)7-10-6-11(8-14-2)15(3)13(9)10/h5-7,14H,8H2,1-4H3.
What are the key properties of 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine?
1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine has a molecular weight of 218.30 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-1,7-dimethylindol-2-yl)-N-methylmethanamine is sourced from PubChem (CID 84622943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).