2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine

C15H22N2 — CID 83948286

IUPAC2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine
SMILESCc1cc2c(CCN)cn(C(C)C)c2cc1C
InChIInChI=1S/C15H22N2/c1-10(2)17-9-13(5-6-16)14-7-11(3)12(4)8-15(14)17/h7-10H,5-6,16H2,1-4H3
InChIKeyDVXJELFGPDIWNG-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.34
Rot. Bonds3

About 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine

2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine (PubChem CID 83948286) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine.

Molecular Properties

Compound Name2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine
PubChem CID83948286
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine
SMILESCc1cc2c(CCN)cn(C(C)C)c2cc1C
InChIInChI=1S/C15H22N2/c1-10(2)17-9-13(5-6-16)14-7-11(3)12(4)8-15(14)17/h7-10H,5-6,16H2,1-4H3
InChIKeyDVXJELFGPDIWNG-UHFFFAOYSA-N
XLogP3.34
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine?
The IUPAC name of 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine (CID 83948286) is 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine.
What is the SMILES notation for 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine?
The canonical SMILES for 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine is Cc1cc2c(CCN)cn(C(C)C)c2cc1C.
What is the InChIKey of 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine?
The InChIKey is DVXJELFGPDIWNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-10(2)17-9-13(5-6-16)14-7-11(3)12(4)8-15(14)17/h7-10H,5-6,16H2,1-4H3.
What are the key properties of 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine?
2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine has a molecular weight of 230.35 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethyl-1-propan-2-ylindol-3-yl)ethanamine is sourced from PubChem (CID 83948286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).