3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine

C18H25NO — CID 66358625

IUPAC3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine
SMILESNC1CC(Oc2ccc3c(c2)CCC3)C12CCCCC2
InChIInChI=1S/C18H25NO/c19-16-12-17(18(16)9-2-1-3-10-18)20-15-8-7-13-5-4-6-14(13)11-15/h7-8,11,16-17H,1-6,9-10,12,19H2
InChIKeyDKJXICWMMUGOJV-UHFFFAOYSA-N
MW271.40 g/mol
LogP3.60
Rot. Bonds2

About 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine

3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine (PubChem CID 66358625) has the molecular formula C18H25NO and a molecular weight of 271.40 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine
PubChem CID66358625
Molecular FormulaC18H25NO
Molecular Weight271.40 g/mol
Exact Mass271.19
IUPAC Name3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine
SMILESNC1CC(Oc2ccc3c(c2)CCC3)C12CCCCC2
InChIInChI=1S/C18H25NO/c19-16-12-17(18(16)9-2-1-3-10-18)20-15-8-7-13-5-4-6-14(13)11-15/h7-8,11,16-17H,1-6,9-10,12,19H2
InChIKeyDKJXICWMMUGOJV-UHFFFAOYSA-N
XLogP3.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.40
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-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 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine?
The IUPAC name of 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine (CID 66358625) is 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine.
What is the SMILES notation for 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine?
The canonical SMILES for 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine is NC1CC(Oc2ccc3c(c2)CCC3)C12CCCCC2.
What is the InChIKey of 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine?
The InChIKey is DKJXICWMMUGOJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25NO/c19-16-12-17(18(16)9-2-1-3-10-18)20-15-8-7-13-5-4-6-14(13)11-15/h7-8,11,16-17H,1-6,9-10,12,19H2.
What are the key properties of 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine?
3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine has a molecular weight of 271.40 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-inden-5-yloxy)spiro[3.5]nonan-1-amine is sourced from PubChem (CID 66358625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).