1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine

C17H24N2 — CID 84636329

IUPAC1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine
SMILESCCc1cccc2c(C3(CNC)CC3)c(C)n(C)c12
InChIInChI=1S/C17H24N2/c1-5-13-7-6-8-14-15(12(2)19(4)16(13)14)17(9-10-17)11-18-3/h6-8,18H,5,9-11H2,1-4H3
InChIKeyWMSPELUTOTUQDA-UHFFFAOYSA-N
MW256.39 g/mol
LogP3.30
Rot. Bonds4

About 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine

1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine (PubChem CID 84636329) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine
PubChem CID84636329
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine
SMILESCCc1cccc2c(C3(CNC)CC3)c(C)n(C)c12
InChIInChI=1S/C17H24N2/c1-5-13-7-6-8-14-15(12(2)19(4)16(13)14)17(9-10-17)11-18-3/h6-8,18H,5,9-11H2,1-4H3
InChIKeyWMSPELUTOTUQDA-UHFFFAOYSA-N
XLogP3.30
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine?
The IUPAC name of 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine (CID 84636329) is 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine is CCc1cccc2c(C3(CNC)CC3)c(C)n(C)c12.
What is the InChIKey of 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine?
The InChIKey is WMSPELUTOTUQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-5-13-7-6-8-14-15(12(2)19(4)16(13)14)17(9-10-17)11-18-3/h6-8,18H,5,9-11H2,1-4H3.
What are the key properties of 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine?
1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine has a molecular weight of 256.39 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(7-ethyl-1,2-dimethylindol-3-yl)cyclopropyl]-N-methylmethanamine is sourced from PubChem (CID 84636329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).