ethane;methyl (1Z)-N-methylethanehydrazonate

C6H16N2O — CID 167502195

IUPACethane;methyl (1Z)-N-methylethanehydrazonate
SMILESCC.CN/N=C(/C)OC
InChIInChI=1S/C4H10N2O.C2H6/c1-4(7-3)6-5-2;1-2/h5H,1-3H3;1-2H3/b6-4-;
InChIKeyJUWCRTJBXQCXPW-YHSAGPEESA-N
MW132.21 g/mol
LogP1.21
Rot. Bonds1

About ethane;methyl (1Z)-N-methylethanehydrazonate

ethane;methyl (1Z)-N-methylethanehydrazonate (PubChem CID 167502195) has the molecular formula C6H16N2O and a molecular weight of 132.21 g/mol. Its IUPAC name is ethane;methyl (1Z)-N-methylethanehydrazonate.

Molecular Properties

Compound Nameethane;methyl (1Z)-N-methylethanehydrazonate
PubChem CID167502195
Molecular FormulaC6H16N2O
Molecular Weight132.21 g/mol
Exact Mass132.13
IUPAC Nameethane;methyl (1Z)-N-methylethanehydrazonate
SMILESCC.CN/N=C(/C)OC
InChIInChI=1S/C4H10N2O.C2H6/c1-4(7-3)6-5-2;1-2/h5H,1-3H3;1-2H3/b6-4-;
InChIKeyJUWCRTJBXQCXPW-YHSAGPEESA-N
XLogP1.21
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

tert-butyl N-methylethanehydrazonate
CID 159503466
N-[3-(methylhydrazinylidene)butan-2-ylideneamino]methanamine
CID 6850505
methyl (1E)-N-methoxycarbonylethanehydrazonate
CID 118028972
N-methoxypropan-2-imine;N-(propan-2-ylideneamino)methanamine
CID 158424207
ethane;methyl (1E)-N-methylsulfanylethanimidate
CID 143212666
N-ethyl-N-methyl-N'-(methylamino)ethanimidamide
CID 166786257
ethane;N-[(Z)-3-methylbut-3-en-2-ylideneamino]methanamine
CID 142059793
methyl (1Z)-N,2-dimethylpropanehydrazonate
CID 139517370
N-[(Z)-but-3-en-2-ylideneamino]methanamine;ethane
CID 142586154
methyl N-hydroxysulfanylethanimidate
CID 71346586
N'-(methylamino)carbamimidate
CID 59074023
(1E)-1-dimethoxyphosphanyl-1-(methylhydrazinylidene)propan-2-one
CID 129091703

Frequently Asked Questions

What is the IUPAC name of ethane;methyl (1Z)-N-methylethanehydrazonate?
The IUPAC name of ethane;methyl (1Z)-N-methylethanehydrazonate (CID 167502195) is ethane;methyl (1Z)-N-methylethanehydrazonate.
What is the SMILES notation for ethane;methyl (1Z)-N-methylethanehydrazonate?
The canonical SMILES for ethane;methyl (1Z)-N-methylethanehydrazonate is CC.CN/N=C(/C)OC.
What is the InChIKey of ethane;methyl (1Z)-N-methylethanehydrazonate?
The InChIKey is JUWCRTJBXQCXPW-YHSAGPEESA-N. The full InChI is InChI=1S/C4H10N2O.C2H6/c1-4(7-3)6-5-2;1-2/h5H,1-3H3;1-2H3/b6-4-;.
What are the key properties of ethane;methyl (1Z)-N-methylethanehydrazonate?
ethane;methyl (1Z)-N-methylethanehydrazonate has a molecular weight of 132.21 g/mol, XLogP of 1.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methyl (1Z)-N-methylethanehydrazonate is sourced from PubChem (CID 167502195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).