N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine

C14H17NO — CID 122463404

IUPACN-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine
SMILESc1ccc2c(c1)CCC21CC1NC1COC1
InChIInChI=1S/C14H17NO/c1-2-4-12-10(3-1)5-6-14(12)7-13(14)15-11-8-16-9-11/h1-4,11,13,15H,5-9H2
InChIKeyGYDWBNKXAZAPSJ-UHFFFAOYSA-N
MW215.30 g/mol
LogP1.63
Rot. Bonds2

About N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine

N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine (PubChem CID 122463404) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine.

Molecular Properties

Compound NameN-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine
PubChem CID122463404
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC NameN-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine
SMILESc1ccc2c(c1)CCC21CC1NC1COC1
InChIInChI=1S/C14H17NO/c1-2-4-12-10(3-1)5-6-14(12)7-13(14)15-11-8-16-9-11/h1-4,11,13,15H,5-9H2
InChIKeyGYDWBNKXAZAPSJ-UHFFFAOYSA-N
XLogP1.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine?
The IUPAC name of N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine (CID 122463404) is N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine.
What is the SMILES notation for N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine?
The canonical SMILES for N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine is c1ccc2c(c1)CCC21CC1NC1COC1.
What is the InChIKey of N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine?
The InChIKey is GYDWBNKXAZAPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-2-4-12-10(3-1)5-6-14(12)7-13(14)15-11-8-16-9-11/h1-4,11,13,15H,5-9H2.
What are the key properties of N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine?
N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine has a molecular weight of 215.30 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-yloxetan-3-amine is sourced from PubChem (CID 122463404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).