2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine

C13H18N2 — CID 86712779

IUPAC2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine
SMILESNCCN1CCC2(CC2)c2ccccc21
InChIInChI=1S/C13H18N2/c14-8-10-15-9-7-13(5-6-13)11-3-1-2-4-12(11)15/h1-4H,5-10,14H2
InChIKeyBFFLNSGPORPYEG-UHFFFAOYSA-N
MW202.30 g/mol
LogP1.89
Rot. Bonds2

About 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine

2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine (PubChem CID 86712779) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine.

Molecular Properties

Compound Name2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine
PubChem CID86712779
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine
SMILESNCCN1CCC2(CC2)c2ccccc21
InChIInChI=1S/C13H18N2/c14-8-10-15-9-7-13(5-6-13)11-3-1-2-4-12(11)15/h1-4H,5-10,14H2
InChIKeyBFFLNSGPORPYEG-UHFFFAOYSA-N
XLogP1.89
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine?
The IUPAC name of 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine (CID 86712779) is 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine.
What is the SMILES notation for 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine?
The canonical SMILES for 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine is NCCN1CCC2(CC2)c2ccccc21.
What is the InChIKey of 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine?
The InChIKey is BFFLNSGPORPYEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c14-8-10-15-9-7-13(5-6-13)11-3-1-2-4-12(11)15/h1-4H,5-10,14H2.
What are the key properties of 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine?
2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine has a molecular weight of 202.30 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-spiro[2,3-dihydroquinoline-4,1'-cyclopropane]-1-ylethanamine is sourced from PubChem (CID 86712779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).