ethene;N'-methylbenzenecarboximidamide

C10H14N2 — CID 142294327

IUPACethene;N'-methylbenzenecarboximidamide
SMILESC/N=C(\N)c1ccccc1.C=C
InChIInChI=1S/C8H10N2.C2H4/c1-10-8(9)7-5-3-2-4-6-7;1-2/h2-6H,1H3,(H2,9,10);1-2H2
InChIKeyHGXKJTKNBZJNSO-UHFFFAOYSA-N
MW162.24 g/mol
LogP1.82
Rot. Bonds1

About ethene;N'-methylbenzenecarboximidamide

ethene;N'-methylbenzenecarboximidamide (PubChem CID 142294327) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is ethene;N'-methylbenzenecarboximidamide.

Molecular Properties

Compound Nameethene;N'-methylbenzenecarboximidamide
PubChem CID142294327
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC Nameethene;N'-methylbenzenecarboximidamide
SMILESC/N=C(\N)c1ccccc1.C=C
InChIInChI=1S/C8H10N2.C2H4/c1-10-8(9)7-5-3-2-4-6-7;1-2/h2-6H,1H3,(H2,9,10);1-2H2
InChIKeyHGXKJTKNBZJNSO-UHFFFAOYSA-N
XLogP1.82
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-hydroxy-N'-methylbenzenecarboximidamide
CID 135965183
N'-hydroxybenzenecarboximidamide
CID 142861747
N'-aminobenzenecarboximidamide
CID 5474957
N'-hydroxybenzenecarboximidamide;pentahydrate
CID 174367022
N'-methoxybenzenecarboximidamide
CID 10678407
3-tert-butyl-N'-methylbenzenecarboximidamide
CID 123779224
N'-(methylamino)benzenecarboximidamide;hydroiodide
CID 12566592
benzamide;ethene
CID 143479548
N'-[(Z)-ethylideneamino]benzenecarboximidamide
CID 23272286
N'-[(Z)-prop-1-enyl]benzenecarboximidamide
CID 137386486
[amino(phenyl)methylidene]carbamic acid
CID 54409873
N'-methyl-2-(1-phenylethenylimino)propanimidamide
CID 123327776

Frequently Asked Questions

What is the IUPAC name of ethene;N'-methylbenzenecarboximidamide?
The IUPAC name of ethene;N'-methylbenzenecarboximidamide (CID 142294327) is ethene;N'-methylbenzenecarboximidamide.
What is the SMILES notation for ethene;N'-methylbenzenecarboximidamide?
The canonical SMILES for ethene;N'-methylbenzenecarboximidamide is C/N=C(\N)c1ccccc1.C=C.
What is the InChIKey of ethene;N'-methylbenzenecarboximidamide?
The InChIKey is HGXKJTKNBZJNSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.C2H4/c1-10-8(9)7-5-3-2-4-6-7;1-2/h2-6H,1H3,(H2,9,10);1-2H2.
What are the key properties of ethene;N'-methylbenzenecarboximidamide?
ethene;N'-methylbenzenecarboximidamide has a molecular weight of 162.24 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;N'-methylbenzenecarboximidamide is sourced from PubChem (CID 142294327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).