2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide

C8H14N2 — CID 139501924

IUPAC2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide
SMILESC=N/C(=N\C=C/C)C(C)C
InChIInChI=1S/C8H14N2/c1-5-6-10-8(9-4)7(2)3/h5-7H,4H2,1-3H3/b6-5-,10-8-
InChIKeyGZLMCJKXGVOBSK-XUTLIFGGSA-N
MW138.21 g/mol
LogP2.28
Rot. Bonds2

About 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide

2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide (PubChem CID 139501924) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide.

Molecular Properties

Compound Name2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide
PubChem CID139501924
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide
SMILESC=N/C(=N\C=C/C)C(C)C
InChIInChI=1S/C8H14N2/c1-5-6-10-8(9-4)7(2)3/h5-7H,4H2,1-3H3/b6-5-,10-8-
InChIKeyGZLMCJKXGVOBSK-XUTLIFGGSA-N
XLogP2.28
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

carbanide;2-propan-2-yl-4H-pyrimidin-4-ide;tungsten(2+)
CID 57856141
propane;2-propan-2-yl-4H-pyrimidin-4-ide;vanadium(2+)
CID 58748049
N-methylidene-N'-[(Z)-prop-1-enyl]ethanimidamide
CID 88586058
N'-[(1Z)-buta-1,3-dienyl]-2-methylpropanimidamide
CID 89140157
2-methyl-N'-[(Z)-prop-1-enyl]-N-prop-2-enylideneprop-2-enimidamide
CID 89278504
1-(4H-imidazol-2-yl)-N-[(Z)-prop-1-enyl]methanimine
CID 118970757
2-Tert-butyl-1,3-diazacyclohepta-2,4,6,7-tetraene
CID 124201303
2,2-dimethyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide
CID 126624382
2-Propan-2-yl-1,3-diazacyclohepta-2,4,6,7-tetraene
CID 126626429
N'-ethenyl-2,2-dimethyl-N-prop-2-enylidenepropanimidamide
CID 126693281
N-(2-aminoethenylidene)-2-methyl-N'-[(Z)-prop-1-enyl]propanimidamide
CID 129119779
N'-ethenyl-N-[(2-methylpropylideneamino)methylidene]methanimidamide
CID 129239004

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide?
The IUPAC name of 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide (CID 139501924) is 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide.
What is the SMILES notation for 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide?
The canonical SMILES for 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide is C=N/C(=N\C=C/C)C(C)C.
What is the InChIKey of 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide?
The InChIKey is GZLMCJKXGVOBSK-XUTLIFGGSA-N. The full InChI is InChI=1S/C8H14N2/c1-5-6-10-8(9-4)7(2)3/h5-7H,4H2,1-3H3/b6-5-,10-8-.
What are the key properties of 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide?
2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide has a molecular weight of 138.21 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-methylidene-N'-[(Z)-prop-1-enyl]propanimidamide is sourced from PubChem (CID 139501924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).