2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine

C14H21N — CID 82076845

IUPAC2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine
SMILESCC(C)c1ccc2c(c1)C(CCN)CC2
InChIInChI=1S/C14H21N/c1-10(2)13-6-5-11-3-4-12(7-8-15)14(11)9-13/h5-6,9-10,12H,3-4,7-8,15H2,1-2H3
InChIKeyJGZWRMCQFFVEMK-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.19
Rot. Bonds3

About 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine

2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine (PubChem CID 82076845) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine.

Molecular Properties

Compound Name2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine
PubChem CID82076845
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine
SMILESCC(C)c1ccc2c(c1)C(CCN)CC2
InChIInChI=1S/C14H21N/c1-10(2)13-6-5-11-3-4-12(7-8-15)14(11)9-13/h5-6,9-10,12H,3-4,7-8,15H2,1-2H3
InChIKeyJGZWRMCQFFVEMK-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine?
The IUPAC name of 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine (CID 82076845) is 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine.
What is the SMILES notation for 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine?
The canonical SMILES for 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine is CC(C)c1ccc2c(c1)C(CCN)CC2.
What is the InChIKey of 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine?
The InChIKey is JGZWRMCQFFVEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-10(2)13-6-5-11-3-4-12(7-8-15)14(11)9-13/h5-6,9-10,12H,3-4,7-8,15H2,1-2H3.
What are the key properties of 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine?
2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine has a molecular weight of 203.33 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-propan-2-yl-2,3-dihydro-1H-inden-1-yl)ethanamine is sourced from PubChem (CID 82076845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).