3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine

C14H30N2O — CID 62437434

IUPAC3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine
SMILESCC(C)CNCC(C(C)C)N1CCOC(C)C1
InChIInChI=1S/C14H30N2O/c1-11(2)8-15-9-14(12(3)4)16-6-7-17-13(5)10-16/h11-15H,6-10H2,1-5H3
InChIKeyYCIYHGCWFPKYNG-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.98
Rot. Bonds6

About 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine

3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine (PubChem CID 62437434) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine.

Molecular Properties

Compound Name3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine
PubChem CID62437434
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine
SMILESCC(C)CNCC(C(C)C)N1CCOC(C)C1
InChIInChI=1S/C14H30N2O/c1-11(2)8-15-9-14(12(3)4)16-6-7-17-13(5)10-16/h11-15H,6-10H2,1-5H3
InChIKeyYCIYHGCWFPKYNG-UHFFFAOYSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-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-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
The IUPAC name of 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine (CID 62437434) is 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine.
What is the SMILES notation for 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
The canonical SMILES for 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine is CC(C)CNCC(C(C)C)N1CCOC(C)C1.
What is the InChIKey of 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
The InChIKey is YCIYHGCWFPKYNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-11(2)8-15-9-14(12(3)4)16-6-7-17-13(5)10-16/h11-15H,6-10H2,1-5H3.
What are the key properties of 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine?
3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine has a molecular weight of 242.41 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-(2-methylmorpholin-4-yl)-N-(2-methylpropyl)butan-1-amine is sourced from PubChem (CID 62437434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).