N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine

C6H13NO2 — CID 853398

IUPACN-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine
SMILESCNCC1(C)OCCO1
InChIInChI=1S/C6H13NO2/c1-6(5-7-2)8-3-4-9-6/h7H,3-5H2,1-2H3
InChIKeyGIAIOMKHJFFNRD-UHFFFAOYSA-N
MW131.18 g/mol
LogP-0.03
Rot. Bonds2

About N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine

N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine (PubChem CID 853398) has the molecular formula C6H13NO2 and a molecular weight of 131.18 g/mol. Its IUPAC name is N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine
PubChem CID853398
Molecular FormulaC6H13NO2
Molecular Weight131.18 g/mol
Exact Mass131.09
IUPAC NameN-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine
SMILESCNCC1(C)OCCO1
InChIInChI=1S/C6H13NO2/c1-6(5-7-2)8-3-4-9-6/h7H,3-5H2,1-2H3
InChIKeyGIAIOMKHJFFNRD-UHFFFAOYSA-N
XLogP-0.03
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.18
LogP ≤ 5-0.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine (CID 853398) is N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine is CNCC1(C)OCCO1.
What is the InChIKey of N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine?
The InChIKey is GIAIOMKHJFFNRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO2/c1-6(5-7-2)8-3-4-9-6/h7H,3-5H2,1-2H3.
What are the key properties of N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine?
N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine has a molecular weight of 131.18 g/mol, XLogP of -0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyl-1,3-dioxolan-2-yl)methanamine is sourced from PubChem (CID 853398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).