N-(diethoxymethylideneamino)methanamine

C6H14N2O2 — CID 23269000

IUPACN-(diethoxymethylideneamino)methanamine
SMILESCCOC(=NNC)OCC
InChIInChI=1S/C6H14N2O2/c1-4-9-6(8-7-3)10-5-2/h7H,4-5H2,1-3H3
InChIKeyNMKKTZKJBDWMEZ-UHFFFAOYSA-N
MW146.19 g/mol
LogP0.55
Rot. Bonds3

About N-(diethoxymethylideneamino)methanamine

N-(diethoxymethylideneamino)methanamine (PubChem CID 23269000) has the molecular formula C6H14N2O2 and a molecular weight of 146.19 g/mol. Its IUPAC name is N-(diethoxymethylideneamino)methanamine.

Molecular Properties

Compound NameN-(diethoxymethylideneamino)methanamine
PubChem CID23269000
Molecular FormulaC6H14N2O2
Molecular Weight146.19 g/mol
Exact Mass146.11
IUPAC NameN-(diethoxymethylideneamino)methanamine
SMILESCCOC(=NNC)OCC
InChIInChI=1S/C6H14N2O2/c1-4-9-6(8-7-3)10-5-2/h7H,4-5H2,1-3H3
InChIKeyNMKKTZKJBDWMEZ-UHFFFAOYSA-N
XLogP0.55
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

ethyl 2-bromo-2-(methylhydrazinylidene)acetate
CID 86223130
ethyl N-(dimethoxymethylideneamino)carbamate
CID 151130925
diethyl N,N'-dihydroxypropanediimidate
CID 174681376
CID 175796855
CID 175796855
ethyl 2-(methylaminooxy)acetate
CID 15922728
N'-(methylamino)-N-propylideneethanimidamide
CID 166794692
azane;2-hydroxy-N'-(methylamino)butanimidamide
CID 172928382
ethyl (2Z)-3-bromo-2-(methylhydrazinylidene)-4-(2-methylpropylamino)butanoate
CID 170052633
(2Z)-2-(methylhydrazinylidene)propanamide
CID 55290878
ethyl 2-(methylamino)-2-methyliminoethanimidate
CID 177040509
ethyl N-(methylcarbamoylamino)carbamate
CID 568737
ethyl (2E)-2-(dibenzylamino)-2-(methylhydrazinylidene)acetate
CID 164518528

Frequently Asked Questions

What is the IUPAC name of N-(diethoxymethylideneamino)methanamine?
The IUPAC name of N-(diethoxymethylideneamino)methanamine (CID 23269000) is N-(diethoxymethylideneamino)methanamine.
What is the SMILES notation for N-(diethoxymethylideneamino)methanamine?
The canonical SMILES for N-(diethoxymethylideneamino)methanamine is CCOC(=NNC)OCC.
What is the InChIKey of N-(diethoxymethylideneamino)methanamine?
The InChIKey is NMKKTZKJBDWMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-4-9-6(8-7-3)10-5-2/h7H,4-5H2,1-3H3.
What are the key properties of N-(diethoxymethylideneamino)methanamine?
N-(diethoxymethylideneamino)methanamine has a molecular weight of 146.19 g/mol, XLogP of 0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(diethoxymethylideneamino)methanamine is sourced from PubChem (CID 23269000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).