2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine

C11H21NO3 — CID 106658862

IUPAC2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine
SMILESCC1(CNC2COC(C)(C)OC2)COC1
InChIInChI=1S/C11H21NO3/c1-10(2)14-4-9(5-15-10)12-6-11(3)7-13-8-11/h9,12H,4-8H2,1-3H3
InChIKeyRZZPRGGKGLBTNC-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.76
Rot. Bonds3

About 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine

2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine (PubChem CID 106658862) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine
PubChem CID106658862
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine
SMILESCC1(CNC2COC(C)(C)OC2)COC1
InChIInChI=1S/C11H21NO3/c1-10(2)14-4-9(5-15-10)12-6-11(3)7-13-8-11/h9,12H,4-8H2,1-3H3
InChIKeyRZZPRGGKGLBTNC-UHFFFAOYSA-N
XLogP0.76
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[(2,2-dimethyl-1,3-dioxan-5-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 106658812
N-(2,2-difluoroethyl)-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658931
1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine
CID 81345344
N-methyl-1-(3-methyloxetan-3-yl)methanamine
CID 42564177
3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]propanoic acid
CID 106658180
2,2-dimethyl-N-[2-(oxolan-3-yl)ethyl]-1,3-dioxan-5-amine
CID 102673023
N-(2,2-dimethyl-1,3-dioxan-5-yl)-N',N'-dimethylpropane-1,3-diamine
CID 106658058
N-[(3-methyloxolan-3-yl)methyl]cyclobutanamine
CID 130621360
2-methyl-N-[(3-methyloxetan-3-yl)methyl]oxolan-3-amine
CID 115338684
N-(2-cyclopentylethyl)-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658581
N-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]ethyl]acetamide
CID 106658128
1-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-3-methylbutan-2-ol
CID 106659034

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine?
The IUPAC name of 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine (CID 106658862) is 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine?
The canonical SMILES for 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine is CC1(CNC2COC(C)(C)OC2)COC1.
What is the InChIKey of 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine?
The InChIKey is RZZPRGGKGLBTNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-10(2)14-4-9(5-15-10)12-6-11(3)7-13-8-11/h9,12H,4-8H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine?
2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine has a molecular weight of 215.29 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]-1,3-dioxan-5-amine is sourced from PubChem (CID 106658862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).