N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine

C10H22N2O — CID 102696242

IUPACN-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCOC(C)CNC1CC(C)N(C)C1
InChIInChI=1S/C10H22N2O/c1-8-5-10(7-12(8)3)11-6-9(2)13-4/h8-11H,5-7H2,1-4H3
InChIKeyUEORSDMXVYPAJY-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.70
Rot. Bonds4

About N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine

N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine (PubChem CID 102696242) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine
PubChem CID102696242
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine
SMILESCOC(C)CNC1CC(C)N(C)C1
InChIInChI=1S/C10H22N2O/c1-8-5-10(7-12(8)3)11-6-9(2)13-4/h8-11H,5-7H2,1-4H3
InChIKeyUEORSDMXVYPAJY-UHFFFAOYSA-N
XLogP0.70
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine?
The IUPAC name of N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine (CID 102696242) is N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine.
What is the SMILES notation for N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine?
The canonical SMILES for N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine is COC(C)CNC1CC(C)N(C)C1.
What is the InChIKey of N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine?
The InChIKey is UEORSDMXVYPAJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-8-5-10(7-12(8)3)11-6-9(2)13-4/h8-11H,5-7H2,1-4H3.
What are the key properties of N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine?
N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine has a molecular weight of 186.30 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypropyl)-1,5-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 102696242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).