2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine

C14H20N2 — CID 84622480

IUPAC2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine
SMILESCCc1cccc2c(C(C)(C)N)c(C)[nH]c12
InChIInChI=1S/C14H20N2/c1-5-10-7-6-8-11-12(14(3,4)15)9(2)16-13(10)11/h6-8,16H,5,15H2,1-4H3
InChIKeyMAUROWSGHLPKCR-UHFFFAOYSA-N
MW216.33 g/mol
LogP3.23
Rot. Bonds2

About 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine

2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine (PubChem CID 84622480) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine.

Molecular Properties

Compound Name2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine
PubChem CID84622480
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine
SMILESCCc1cccc2c(C(C)(C)N)c(C)[nH]c12
InChIInChI=1S/C14H20N2/c1-5-10-7-6-8-11-12(14(3,4)15)9(2)16-13(10)11/h6-8,16H,5,15H2,1-4H3
InChIKeyMAUROWSGHLPKCR-UHFFFAOYSA-N
XLogP3.23
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine?
The IUPAC name of 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine (CID 84622480) is 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine.
What is the SMILES notation for 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine?
The canonical SMILES for 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine is CCc1cccc2c(C(C)(C)N)c(C)[nH]c12.
What is the InChIKey of 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine?
The InChIKey is MAUROWSGHLPKCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-5-10-7-6-8-11-12(14(3,4)15)9(2)16-13(10)11/h6-8,16H,5,15H2,1-4H3.
What are the key properties of 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine?
2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine has a molecular weight of 216.33 g/mol, XLogP of 3.23, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-ethyl-2-methyl-1H-indol-3-yl)propan-2-amine is sourced from PubChem (CID 84622480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).