methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate

C8H16N2O — CID 134925290

IUPACmethyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate
SMILESCO/C(=N\N=C(C)C)C(C)C
InChIInChI=1S/C8H16N2O/c1-6(2)8(11-5)10-9-7(3)4/h6H,1-5H3/b10-8-
InChIKeyHRMASIGOUIBUKV-NTMALXAHSA-N
MW156.23 g/mol
LogP2.08
Rot. Bonds2

About methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate

methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate (PubChem CID 134925290) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate.

Molecular Properties

Compound Namemethyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate
PubChem CID134925290
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Namemethyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate
SMILESCO/C(=N\N=C(C)C)C(C)C
InChIInChI=1S/C8H16N2O/c1-6(2)8(11-5)10-9-7(3)4/h6H,1-5H3/b10-8-
InChIKeyHRMASIGOUIBUKV-NTMALXAHSA-N
XLogP2.08
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 52.08
H-Bond Donors ≤ 50
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

methyl (1Z)-N,2-dimethylpropanehydrazonate
CID 139517370
(Z)-2-methyl-N-(propan-2-ylideneamino)propan-1-imine
CID 91540977
methane;(Z)-2,3,4,5-tetramethylhex-3-ene;(E)-2,3,4,5-tetramethylhex-3-ene
CID 161097810
(1-methoxy-2-methylpropylidene)tungsten
CID 15253385
2-chloropropane;methyl acetate
CID 157293612
N-di(propan-2-yl)silyloxypropan-2-imine
CID 173001204
ethyl (1E)-N-propan-2-ylideneethanehydrazonate
CID 131862809
N'-ethenyl-N-methoxy-2-methylpropanimidamide
CID 91490081
methyl 2-aminopropanoate;methyl 2-(propan-2-ylideneamino)propanoate;propan-2-imine;propan-2-one
CID 161380523
methyl 2-methylpropanoate;titanium
CID 174633551
N-diazenylpropan-2-imine
CID 123232444
N-(propan-2-ylideneamino)butan-2-imine
CID 59062083

Frequently Asked Questions

What is the IUPAC name of methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate?
The IUPAC name of methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate (CID 134925290) is methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate.
What is the SMILES notation for methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate?
The canonical SMILES for methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate is CO/C(=N\N=C(C)C)C(C)C.
What is the InChIKey of methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate?
The InChIKey is HRMASIGOUIBUKV-NTMALXAHSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6(2)8(11-5)10-9-7(3)4/h6H,1-5H3/b10-8-.
What are the key properties of methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate?
methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate has a molecular weight of 156.23 g/mol, XLogP of 2.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (1Z)-2-methyl-N-propan-2-ylidenepropanehydrazonate is sourced from PubChem (CID 134925290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).