[4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol

C15H30N2O2 — CID 105417449

IUPAC[4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol
SMILESCN(CC1(CO)CCOCC1)CC1(N(C)C)CCC1
InChIInChI=1S/C15H30N2O2/c1-16(2)15(5-4-6-15)12-17(3)11-14(13-18)7-9-19-10-8-14/h18H,4-13H2,1-3H3
InChIKeyQEKSLHQXNZUESX-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.19
Rot. Bonds6

About [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol

[4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol (PubChem CID 105417449) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol.

Molecular Properties

Compound Name[4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol
PubChem CID105417449
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC Name[4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol
SMILESCN(CC1(CO)CCOCC1)CC1(N(C)C)CCC1
InChIInChI=1S/C15H30N2O2/c1-16(2)15(5-4-6-15)12-17(3)11-14(13-18)7-9-19-10-8-14/h18H,4-13H2,1-3H3
InChIKeyQEKSLHQXNZUESX-UHFFFAOYSA-N
XLogP1.19
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol with MolForge

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Related Compounds

[4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanethiol
CID 105418776
3-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxolane-3-carboxylic acid
CID 105417376
1-[[4-(hydroxymethyl)oxan-4-yl]methyl-methylamino]propan-2-ol
CID 62392254
1-[[[1-(bromomethyl)cyclopropyl]methyl-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105416258
[4-[[methyl(pentyl)amino]methyl]oxan-4-yl]methanol
CID 62391542
[4-[[methyl(oxan-2-ylmethyl)amino]methyl]oxan-4-yl]methanol
CID 62391719
1-[[[1-(ethylaminomethyl)cyclopentyl]methyl-methylamino]methyl]-N,N-dimethylcyclobutan-1-amine
CID 105417297
[4-[[methyl-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]amino]methyl]oxan-4-yl]methanol
CID 91841621
2-[[4-[(tert-butylamino)methyl]oxan-4-yl]methyl-methylamino]ethanol
CID 62390793
4-(aminomethyl)-N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyloxepan-4-amine
CID 105414221
2-[[4-(hydroxymethyl)oxan-4-yl]methyl-methylamino]propan-1-ol
CID 104554785
[1-[[cyclohexylmethyl(methyl)amino]methyl]cyclobutyl]methanol
CID 115247051

Frequently Asked Questions

What is the IUPAC name of [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol?
The IUPAC name of [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol (CID 105417449) is [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol.
What is the SMILES notation for [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol?
The canonical SMILES for [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol is CN(CC1(CO)CCOCC1)CC1(N(C)C)CCC1.
What is the InChIKey of [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol?
The InChIKey is QEKSLHQXNZUESX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-16(2)15(5-4-6-15)12-17(3)11-14(13-18)7-9-19-10-8-14/h18H,4-13H2,1-3H3.
What are the key properties of [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol?
[4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol has a molecular weight of 270.42 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[[[1-(dimethylamino)cyclobutyl]methyl-methylamino]methyl]oxan-4-yl]methanol is sourced from PubChem (CID 105417449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).