N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine

C4H10N4O2 — CID 54276678

IUPACN,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine
SMILESCNCC(N=O)(N=O)NC
InChIInChI=1S/C4H10N4O2/c1-5-3-4(6-2,7-9)8-10/h5-6H,3H2,1-2H3
InChIKeyRNWZEMBADGWUBF-UHFFFAOYSA-N
MW146.15 g/mol
LogP-0.39
Rot. Bonds5

About N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine

N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine (PubChem CID 54276678) has the molecular formula C4H10N4O2 and a molecular weight of 146.15 g/mol. Its IUPAC name is N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine.

Molecular Properties

Compound NameN,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine
PubChem CID54276678
Molecular FormulaC4H10N4O2
Molecular Weight146.15 g/mol
Exact Mass146.08
IUPAC NameN,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine
SMILESCNCC(N=O)(N=O)NC
InChIInChI=1S/C4H10N4O2/c1-5-3-4(6-2,7-9)8-10/h5-6H,3H2,1-2H3
InChIKeyRNWZEMBADGWUBF-UHFFFAOYSA-N
XLogP-0.39
TPSA82.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

1-N'-methyl-2-nitroethane-1,1-diamine
CID 19031282
N,N'-diethyl-1-nitrosoethane-1,2-diamine
CID 21404115
N,N'-dimethyl-1,2-dinitrosoethane-1,2-diamine
CID 21404118
1-N,2-N-dimethyl-1,1-dinitrosopropane-1,2-diamine
CID 53965870
N,N'-dimethyl-1,1-dinitrosopropane-1,3-diamine
CID 57157870
N,N'-bis(nitrosomethyl)ethane-1,2-diamine
CID 90384114
N-methyl-N'-(nitrosomethyl)ethane-1,2-diamine
CID 118616890
N-methyl-N'-(nitromethyl)ethane-1,2-diamine
CID 145692557
N,N'-bis(2-nitrosoethyl)ethane-1,2-diamine
CID 153611377
N-ethyl-2-nitrosoethanamine oxide
CID 163564852
N'-[2-[2-nitrosoethyl(oxido)amino]ethyl]ethane-1,2-diamine
CID 173325214

Frequently Asked Questions

What is the IUPAC name of N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine?
The IUPAC name of N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine (CID 54276678) is N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine.
What is the SMILES notation for N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine?
The canonical SMILES for N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine is CNCC(N=O)(N=O)NC.
What is the InChIKey of N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine?
The InChIKey is RNWZEMBADGWUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N4O2/c1-5-3-4(6-2,7-9)8-10/h5-6H,3H2,1-2H3.
What are the key properties of N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine?
N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine has a molecular weight of 146.15 g/mol, XLogP of -0.39, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethyl-1,1-dinitrosoethane-1,2-diamine is sourced from PubChem (CID 54276678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).