2-ethyl-2-(methoxymethyl)propane-1,3-diamine

C7H18N2O — CID 14552511

IUPAC2-ethyl-2-(methoxymethyl)propane-1,3-diamine
SMILESCCC(CN)(CN)COC
InChIInChI=1S/C7H18N2O/c1-3-7(4-8,5-9)6-10-2/h3-6,8-9H2,1-2H3
InChIKeyDJNANKRNCDXTHD-UHFFFAOYSA-N
MW146.23 g/mol
LogP-0.05
Rot. Bonds5

About 2-ethyl-2-(methoxymethyl)propane-1,3-diamine

2-ethyl-2-(methoxymethyl)propane-1,3-diamine (PubChem CID 14552511) has the molecular formula C7H18N2O and a molecular weight of 146.23 g/mol. Its IUPAC name is 2-ethyl-2-(methoxymethyl)propane-1,3-diamine.

Molecular Properties

Compound Name2-ethyl-2-(methoxymethyl)propane-1,3-diamine
PubChem CID14552511
Molecular FormulaC7H18N2O
Molecular Weight146.23 g/mol
Exact Mass146.14
IUPAC Name2-ethyl-2-(methoxymethyl)propane-1,3-diamine
SMILESCCC(CN)(CN)COC
InChIInChI=1S/C7H18N2O/c1-3-7(4-8,5-9)6-10-2/h3-6,8-9H2,1-2H3
InChIKeyDJNANKRNCDXTHD-UHFFFAOYSA-N
XLogP-0.05
TPSA61.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(methoxymethyl)propane-1,3-diamine?
The IUPAC name of 2-ethyl-2-(methoxymethyl)propane-1,3-diamine (CID 14552511) is 2-ethyl-2-(methoxymethyl)propane-1,3-diamine.
What is the SMILES notation for 2-ethyl-2-(methoxymethyl)propane-1,3-diamine?
The canonical SMILES for 2-ethyl-2-(methoxymethyl)propane-1,3-diamine is CCC(CN)(CN)COC.
What is the InChIKey of 2-ethyl-2-(methoxymethyl)propane-1,3-diamine?
The InChIKey is DJNANKRNCDXTHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O/c1-3-7(4-8,5-9)6-10-2/h3-6,8-9H2,1-2H3.
What are the key properties of 2-ethyl-2-(methoxymethyl)propane-1,3-diamine?
2-ethyl-2-(methoxymethyl)propane-1,3-diamine has a molecular weight of 146.23 g/mol, XLogP of -0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(methoxymethyl)propane-1,3-diamine is sourced from PubChem (CID 14552511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).