methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate

C6H13N3O2 — CID 71366215

IUPACmethyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate
SMILESCOC(=O)N(C)C=NN(C)C
InChIInChI=1S/C6H13N3O2/c1-8(2)7-5-9(3)6(10)11-4/h5H,1-4H3
InChIKeyYNASDMBYSZJMJK-UHFFFAOYSA-N
MW159.19 g/mol
LogP0.19
Rot. Bonds2

About methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate

methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate (PubChem CID 71366215) has the molecular formula C6H13N3O2 and a molecular weight of 159.19 g/mol. Its IUPAC name is methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate.

Molecular Properties

Compound Namemethyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate
PubChem CID71366215
Molecular FormulaC6H13N3O2
Molecular Weight159.19 g/mol
Exact Mass159.10
IUPAC Namemethyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate
SMILESCOC(=O)N(C)C=NN(C)C
InChIInChI=1S/C6H13N3O2/c1-8(2)7-5-9(3)6(10)11-4/h5H,1-4H3
InChIKeyYNASDMBYSZJMJK-UHFFFAOYSA-N
XLogP0.19
TPSA45.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 50.19
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate?
The IUPAC name of methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate (CID 71366215) is methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate.
What is the SMILES notation for methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate?
The canonical SMILES for methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate is COC(=O)N(C)C=NN(C)C.
What is the InChIKey of methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate?
The InChIKey is YNASDMBYSZJMJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O2/c1-8(2)7-5-9(3)6(10)11-4/h5H,1-4H3.
What are the key properties of methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate?
methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate has a molecular weight of 159.19 g/mol, XLogP of 0.19, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[(dimethylhydrazinylidene)methyl]-N-methylcarbamate is sourced from PubChem (CID 71366215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).