3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide

C10H20N2O3 — CID 106658723

IUPAC3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide
SMILESCNC(=O)CCNC1COC(C)(C)OC1
InChIInChI=1S/C10H20N2O3/c1-10(2)14-6-8(7-15-10)12-5-4-9(13)11-3/h8,12H,4-7H2,1-3H3,(H,11,13)
InChIKeyHGLZEDCNMXZUCL-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.14
Rot. Bonds4

About 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide

3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide (PubChem CID 106658723) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide.

Molecular Properties

Compound Name3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide
PubChem CID106658723
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide
SMILESCNC(=O)CCNC1COC(C)(C)OC1
InChIInChI=1S/C10H20N2O3/c1-10(2)14-6-8(7-15-10)12-5-4-9(13)11-3/h8,12H,4-7H2,1-3H3,(H,11,13)
InChIKeyHGLZEDCNMXZUCL-UHFFFAOYSA-N
XLogP-0.14
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]propanoic acid
CID 106658180
N-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]ethyl]acetamide
CID 106658128
3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 106658991
N-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]ethyl]-2-methylpropanamide
CID 106658087
3-[(4,4-dimethylcycloheptyl)amino]-N-methylpropanamide
CID 65083464
3-[(5,5-dimethylthian-3-yl)amino]-N-methylpropanamide
CID 79958079
N-[2-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]ethyl]methanesulfonamide
CID 106658151
2,2-dimethyl-N-(3-methylsulfinylpropyl)-1,3-dioxan-5-amine
CID 106659028
2-[3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]propoxy]ethanol
CID 106309374
4-[[(2,2-dimethyl-1,3-dioxan-5-yl)amino]methyl]-N-methylbenzamide
CID 104588896
N-(2,2-dimethyl-1,3-dioxan-5-yl)-N',N'-dimethylpropane-1,3-diamine
CID 106658058
N-(2-cyclopentylethyl)-2,2-dimethyl-1,3-dioxan-5-amine
CID 106658581

Frequently Asked Questions

What is the IUPAC name of 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide?
The IUPAC name of 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide (CID 106658723) is 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide.
What is the SMILES notation for 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide?
The canonical SMILES for 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide is CNC(=O)CCNC1COC(C)(C)OC1.
What is the InChIKey of 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide?
The InChIKey is HGLZEDCNMXZUCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-10(2)14-6-8(7-15-10)12-5-4-9(13)11-3/h8,12H,4-7H2,1-3H3,(H,11,13).
What are the key properties of 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide?
3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide has a molecular weight of 216.28 g/mol, XLogP of -0.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]-N-methylpropanamide is sourced from PubChem (CID 106658723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).