4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine

C14H23N3O — CID 66264619

IUPAC4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine
SMILESCN(CCc1ccccn1)CC1(C)COCC1N
InChIInChI=1S/C14H23N3O/c1-14(11-18-9-13(14)15)10-17(2)8-6-12-5-3-4-7-16-12/h3-5,7,13H,6,8-11,15H2,1-2H3
InChIKeyUWSPPPUDIGMZLC-UHFFFAOYSA-N
MW249.36 g/mol
LogP0.92
Rot. Bonds5

About 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine

4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine (PubChem CID 66264619) has the molecular formula C14H23N3O and a molecular weight of 249.36 g/mol. Its IUPAC name is 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine.

Molecular Properties

Compound Name4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine
PubChem CID66264619
Molecular FormulaC14H23N3O
Molecular Weight249.36 g/mol
Exact Mass249.18
IUPAC Name4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine
SMILESCN(CCc1ccccn1)CC1(C)COCC1N
InChIInChI=1S/C14H23N3O/c1-14(11-18-9-13(14)15)10-17(2)8-6-12-5-3-4-7-16-12/h3-5,7,13H,6,8-11,15H2,1-2H3
InChIKeyUWSPPPUDIGMZLC-UHFFFAOYSA-N
XLogP0.92
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine?
The IUPAC name of 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine (CID 66264619) is 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine.
What is the SMILES notation for 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine?
The canonical SMILES for 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine is CN(CCc1ccccn1)CC1(C)COCC1N.
What is the InChIKey of 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine?
The InChIKey is UWSPPPUDIGMZLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O/c1-14(11-18-9-13(14)15)10-17(2)8-6-12-5-3-4-7-16-12/h3-5,7,13H,6,8-11,15H2,1-2H3.
What are the key properties of 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine?
4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine has a molecular weight of 249.36 g/mol, XLogP of 0.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-[[methyl(2-pyridin-2-ylethyl)amino]methyl]oxolan-3-amine is sourced from PubChem (CID 66264619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).