methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate

C14H25NO2 — CID 114820854

IUPACmethyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate
SMILESCNC1(CC(=O)OC)CCC2(CCCC2)CC1
InChIInChI=1S/C14H25NO2/c1-15-14(11-12(16)17-2)9-7-13(8-10-14)5-3-4-6-13/h15H,3-11H2,1-2H3
InChIKeyFMTMKMXLSUVIGA-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.64
Rot. Bonds3

About methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate

methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate (PubChem CID 114820854) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate.

Molecular Properties

Compound Namemethyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate
PubChem CID114820854
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Namemethyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate
SMILESCNC1(CC(=O)OC)CCC2(CCCC2)CC1
InChIInChI=1S/C14H25NO2/c1-15-14(11-12(16)17-2)9-7-13(8-10-14)5-3-4-6-13/h15H,3-11H2,1-2H3
InChIKeyFMTMKMXLSUVIGA-UHFFFAOYSA-N
XLogP2.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate 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 methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate?
The IUPAC name of methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate (CID 114820854) is methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate.
What is the SMILES notation for methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate?
The canonical SMILES for methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate is CNC1(CC(=O)OC)CCC2(CCCC2)CC1.
What is the InChIKey of methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate?
The InChIKey is FMTMKMXLSUVIGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-15-14(11-12(16)17-2)9-7-13(8-10-14)5-3-4-6-13/h15H,3-11H2,1-2H3.
What are the key properties of methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate?
methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate has a molecular weight of 239.36 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[8-(methylamino)spiro[4.5]decan-8-yl]acetate is sourced from PubChem (CID 114820854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).