bis(N,N-dimethylmethanamine);dihydrate

C6H22N2O2 — CID 173204316

IUPACbis(N,N-dimethylmethanamine);dihydrate
SMILESCN(C)C.CN(C)C.O.O
InChIInChI=1S/2C3H9N.2H2O/c2*1-4(2)3;;/h2*1-3H3;2*1H2
InChIKeyBCNWZYPMPYNEOX-UHFFFAOYSA-N
MW154.25 g/mol
LogP-1.29
Rot. Bonds

About bis(N,N-dimethylmethanamine);dihydrate

bis(N,N-dimethylmethanamine);dihydrate (PubChem CID 173204316) has the molecular formula C6H22N2O2 and a molecular weight of 154.25 g/mol. Its IUPAC name is bis(N,N-dimethylmethanamine);dihydrate.

Molecular Properties

Compound Namebis(N,N-dimethylmethanamine);dihydrate
PubChem CID173204316
Molecular FormulaC6H22N2O2
Molecular Weight154.25 g/mol
Exact Mass154.17
IUPAC Namebis(N,N-dimethylmethanamine);dihydrate
SMILESCN(C)C.CN(C)C.O.O
InChIInChI=1S/2C3H9N.2H2O/c2*1-4(2)3;;/h2*1-3H3;2*1H2
InChIKeyBCNWZYPMPYNEOX-UHFFFAOYSA-N
XLogP-1.29
TPSA69.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 5-1.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of bis(N,N-dimethylmethanamine);dihydrate?
The IUPAC name of bis(N,N-dimethylmethanamine);dihydrate (CID 173204316) is bis(N,N-dimethylmethanamine);dihydrate.
What is the SMILES notation for bis(N,N-dimethylmethanamine);dihydrate?
The canonical SMILES for bis(N,N-dimethylmethanamine);dihydrate is CN(C)C.CN(C)C.O.O.
What is the InChIKey of bis(N,N-dimethylmethanamine);dihydrate?
The InChIKey is BCNWZYPMPYNEOX-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H9N.2H2O/c2*1-4(2)3;;/h2*1-3H3;2*1H2.
What are the key properties of bis(N,N-dimethylmethanamine);dihydrate?
bis(N,N-dimethylmethanamine);dihydrate has a molecular weight of 154.25 g/mol, XLogP of -1.29, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N,N-dimethylmethanamine);dihydrate is sourced from PubChem (CID 173204316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).