N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine

C16H34N2O — CID 62261226

IUPACN-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine
SMILESCN(CC(C)(C)C)CC1(CNC(C)(C)C)CCOC1
InChIInChI=1S/C16H34N2O/c1-14(2,3)11-18(7)12-16(8-9-19-13-16)10-17-15(4,5)6/h17H,8-13H2,1-7H3
InChIKeyYDTCJGLDBQVLGB-UHFFFAOYSA-N
MW270.46 g/mol
LogP2.76
Rot. Bonds5

About N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine

N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine (PubChem CID 62261226) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine.

Molecular Properties

Compound NameN-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine
PubChem CID62261226
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC NameN-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine
SMILESCN(CC(C)(C)C)CC1(CNC(C)(C)C)CCOC1
InChIInChI=1S/C16H34N2O/c1-14(2,3)11-18(7)12-16(8-9-19-13-16)10-17-15(4,5)6/h17H,8-13H2,1-7H3
InChIKeyYDTCJGLDBQVLGB-UHFFFAOYSA-N
XLogP2.76
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-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 N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine?
The IUPAC name of N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine (CID 62261226) is N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine.
What is the SMILES notation for N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine?
The canonical SMILES for N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine is CN(CC(C)(C)C)CC1(CNC(C)(C)C)CCOC1.
What is the InChIKey of N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine?
The InChIKey is YDTCJGLDBQVLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-14(2,3)11-18(7)12-16(8-9-19-13-16)10-17-15(4,5)6/h17H,8-13H2,1-7H3.
What are the key properties of N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine?
N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine has a molecular weight of 270.46 g/mol, XLogP of 2.76, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(tert-butylamino)methyl]oxolan-3-yl]methyl]-N,2,2-trimethylpropan-1-amine is sourced from PubChem (CID 62261226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).