N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine

C14H30N2O — CID 55056496

IUPACN,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine
SMILESCNCC1(CN(C)C(C)CC(C)C)CCOC1
InChIInChI=1S/C14H30N2O/c1-12(2)8-13(3)16(5)10-14(9-15-4)6-7-17-11-14/h12-13,15H,6-11H2,1-5H3
InChIKeyVVIWTGVEEVXYGQ-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.98
Rot. Bonds7

About N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine

N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine (PubChem CID 55056496) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine
PubChem CID55056496
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC NameN,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine
SMILESCNCC1(CN(C)C(C)CC(C)C)CCOC1
InChIInChI=1S/C14H30N2O/c1-12(2)8-13(3)16(5)10-14(9-15-4)6-7-17-11-14/h12-13,15H,6-11H2,1-5H3
InChIKeyVVIWTGVEEVXYGQ-UHFFFAOYSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
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 N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-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 N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine?
The IUPAC name of N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine (CID 55056496) is N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine.
What is the SMILES notation for N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine?
The canonical SMILES for N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine is CNCC1(CN(C)C(C)CC(C)C)CCOC1.
What is the InChIKey of N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine?
The InChIKey is VVIWTGVEEVXYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-12(2)8-13(3)16(5)10-14(9-15-4)6-7-17-11-14/h12-13,15H,6-11H2,1-5H3.
What are the key properties of N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine?
N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine has a molecular weight of 242.41 g/mol, XLogP of 1.98, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[[3-(methylaminomethyl)oxolan-3-yl]methyl]pentan-2-amine is sourced from PubChem (CID 55056496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).