2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol

C14H27NO3 — CID 82754940

IUPAC2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol
SMILESCN(CC1C(O)C(C)(C)OC1(C)C)C1CCOC1
InChIInChI=1S/C14H27NO3/c1-13(2)11(12(16)14(3,4)18-13)8-15(5)10-6-7-17-9-10/h10-12,16H,6-9H2,1-5H3
InChIKeyOMXLFXXNDMPBSN-UHFFFAOYSA-N
MW257.37 g/mol
LogP1.27
Rot. Bonds3

About 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol

2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol (PubChem CID 82754940) has the molecular formula C14H27NO3 and a molecular weight of 257.37 g/mol. Its IUPAC name is 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol.

Molecular Properties

Compound Name2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol
PubChem CID82754940
Molecular FormulaC14H27NO3
Molecular Weight257.37 g/mol
Exact Mass257.20
IUPAC Name2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol
SMILESCN(CC1C(O)C(C)(C)OC1(C)C)C1CCOC1
InChIInChI=1S/C14H27NO3/c1-13(2)11(12(16)14(3,4)18-13)8-15(5)10-6-7-17-9-10/h10-12,16H,6-9H2,1-5H3
InChIKeyOMXLFXXNDMPBSN-UHFFFAOYSA-N
XLogP1.27
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.37
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,2,5,5-tetramethyl-4-[[methyl(oxan-4-ylmethyl)amino]methyl]oxolan-3-ol
CID 79929474
2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-one
CID 82744002
4-methyl-2-[[methyl(oxolan-3-yl)amino]methyl]cyclohexan-1-ol
CID 82754506
2,2-dimethyl-5-[[methyl(oxan-4-yl)amino]methyl]cyclopentan-1-ol
CID 79855271
N,N'-dimethyl-N,N'-bis[(3S)-oxolan-3-yl]but-2-yne-1,4-diamine
CID 124729941
(2S)-1-[methyl(oxolan-3-yl)amino]propan-2-ol
CID 103935293
N-[(3-bromocyclobutyl)methyl]-N-methyloxolan-3-amine
CID 80690224
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
CID 82743146
2,2,5,5-tetramethyl-4-[[methyl(2-methylbutan-2-yl)amino]methyl]oxolan-3-ol
CID 79929926
N-[(3-aminocyclopentyl)methyl]-N-methyloxolan-3-amine
CID 82739732
N-ethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-amine
CID 82739733
2-[methyl(oxolan-3-yl)amino]acetaldehyde
CID 82742163

Frequently Asked Questions

What is the IUPAC name of 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol?
The IUPAC name of 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol (CID 82754940) is 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol.
What is the SMILES notation for 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol?
The canonical SMILES for 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol is CN(CC1C(O)C(C)(C)OC1(C)C)C1CCOC1.
What is the InChIKey of 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol?
The InChIKey is OMXLFXXNDMPBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO3/c1-13(2)11(12(16)14(3,4)18-13)8-15(5)10-6-7-17-9-10/h10-12,16H,6-9H2,1-5H3.
What are the key properties of 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol?
2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol has a molecular weight of 257.37 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,5-tetramethyl-4-[[methyl(oxolan-3-yl)amino]methyl]oxolan-3-ol is sourced from PubChem (CID 82754940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).