N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine

C16H30N2O2 — CID 62992339

IUPACN-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine
SMILESCC(CNC1CCC2(CC1)OCCO2)CN1CCCC1
InChIInChI=1S/C16H30N2O2/c1-14(13-18-8-2-3-9-18)12-17-15-4-6-16(7-5-15)19-10-11-20-16/h14-15,17H,2-13H2,1H3
InChIKeyALACHPBLPFHRDG-UHFFFAOYSA-N
MW282.43 g/mol
LogP1.99
Rot. Bonds5

About N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine

N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine (PubChem CID 62992339) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine.

Molecular Properties

Compound NameN-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine
PubChem CID62992339
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine
SMILESCC(CNC1CCC2(CC1)OCCO2)CN1CCCC1
InChIInChI=1S/C16H30N2O2/c1-14(13-18-8-2-3-9-18)12-17-15-4-6-16(7-5-15)19-10-11-20-16/h14-15,17H,2-13H2,1H3
InChIKeyALACHPBLPFHRDG-UHFFFAOYSA-N
XLogP1.99
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine with MolForge

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

Launch Full Analysis

Related Compounds

3,3-dimethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)cyclopentan-1-amine
CID 80705127
4-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]cyclohexan-1-ol
CID 106594618
N-(2-methyl-3-morpholin-4-ylpropyl)cyclopentanamine
CID 115641946
2,2-dimethyl-N-(2-methyl-3-piperidin-1-ylpropyl)-1,3-dioxan-5-amine
CID 106658667
1-ethyl-N-(2-methyl-3-piperidin-1-ylpropyl)piperidin-4-amine
CID 54906375
1-[4-[(2-methyl-3-piperidin-1-ylpropyl)amino]piperidin-1-yl]ethanone
CID 60961230
3-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)cyclopentan-1-amine
CID 64502363
1-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)pyrrolidin-3-amine
CID 62975439
N-(2-methyl-3-piperidin-1-ylpropyl)thiolan-3-amine
CID 61020549
1,2-dimethyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)piperidin-4-amine
CID 81296513
1-cyclopropyl-N-(2-methyl-3-piperidin-1-ylpropyl)pyrrolidin-3-amine
CID 62982179
3-(4-methylphenyl)-N-(2-methyl-3-pyrrolidin-1-ylpropyl)cyclobutan-1-amine
CID 62994243

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The IUPAC name of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine (CID 62992339) is N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine.
What is the SMILES notation for N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The canonical SMILES for N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine is CC(CNC1CCC2(CC1)OCCO2)CN1CCCC1.
What is the InChIKey of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine?
The InChIKey is ALACHPBLPFHRDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-14(13-18-8-2-3-9-18)12-17-15-4-6-16(7-5-15)19-10-11-20-16/h14-15,17H,2-13H2,1H3.
What are the key properties of N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine?
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine has a molecular weight of 282.43 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1,4-dioxaspiro[4.5]decan-8-amine is sourced from PubChem (CID 62992339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).