2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine

C15H19N — CID 54082998

IUPAC2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine
SMILESNCC=C1CC2(CCCC2)c2ccccc21
InChIInChI=1S/C15H19N/c16-10-7-12-11-15(8-3-4-9-15)14-6-2-1-5-13(12)14/h1-2,5-7H,3-4,8-11,16H2
InChIKeyMOLCDZQBOUICDO-UHFFFAOYSA-N
MW213.32 g/mol
LogP3.24
Rot. Bonds1

About 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine

2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine (PubChem CID 54082998) has the molecular formula C15H19N and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine.

Molecular Properties

Compound Name2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine
PubChem CID54082998
Molecular FormulaC15H19N
Molecular Weight213.32 g/mol
Exact Mass213.15
IUPAC Name2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine
SMILESNCC=C1CC2(CCCC2)c2ccccc21
InChIInChI=1S/C15H19N/c16-10-7-12-11-15(8-3-4-9-15)14-6-2-1-5-13(12)14/h1-2,5-7H,3-4,8-11,16H2
InChIKeyMOLCDZQBOUICDO-UHFFFAOYSA-N
XLogP3.24
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine?
The IUPAC name of 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine (CID 54082998) is 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine.
What is the SMILES notation for 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine?
The canonical SMILES for 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine is NCC=C1CC2(CCCC2)c2ccccc21.
What is the InChIKey of 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine?
The InChIKey is MOLCDZQBOUICDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N/c16-10-7-12-11-15(8-3-4-9-15)14-6-2-1-5-13(12)14/h1-2,5-7H,3-4,8-11,16H2.
What are the key properties of 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine?
2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine has a molecular weight of 213.32 g/mol, XLogP of 3.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-spiro[2H-indene-3,1'-cyclopentane]-1-ylideneethanamine is sourced from PubChem (CID 54082998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).