N-(2-methanimidoyl-5-methylphenyl)ethanimine

C10H12N2 — CID 118350033

IUPACN-(2-methanimidoyl-5-methylphenyl)ethanimine
SMILES[H]/N=C/c1ccc(C)cc1/N=C/C
InChIInChI=1S/C10H12N2/c1-3-12-10-6-8(2)4-5-9(10)7-11/h3-7,11H,1-2H3/b11-7+,12-3+
InChIKeyCSRJJJNQAJVELO-DTGJFCPMSA-N
MW160.22 g/mol
LogP2.71
Rot. Bonds2

About N-(2-methanimidoyl-5-methylphenyl)ethanimine

N-(2-methanimidoyl-5-methylphenyl)ethanimine (PubChem CID 118350033) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is N-(2-methanimidoyl-5-methylphenyl)ethanimine.

Molecular Properties

Compound NameN-(2-methanimidoyl-5-methylphenyl)ethanimine
PubChem CID118350033
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC NameN-(2-methanimidoyl-5-methylphenyl)ethanimine
SMILES[H]/N=C/c1ccc(C)cc1/N=C/C
InChIInChI=1S/C10H12N2/c1-3-12-10-6-8(2)4-5-9(10)7-11/h3-7,11H,1-2H3/b11-7+,12-3+
InChIKeyCSRJJJNQAJVELO-DTGJFCPMSA-N
XLogP2.71
TPSA36.21 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-methanimidoyl-4-methylbenzaldehyde
CID 22447756
2-methanimidoyl-5-methyl-N-(3-methylphenyl)aniline
CID 155713746
N-(difluoromethyl)-2-methanimidoyl-4-methylaniline
CID 176988772
ethane;2-methanimidoyl-N-(3-methoxypropyl)-5-methylaniline
CID 143562507
(6-methyl-1H-indol-3-yl)methanimine
CID 143049497
N-[2-(ethyliminomethyl)-4-methylphenyl]ethanimine
CID 145271202
1-[2-(ethylideneamino)-4-methylphenyl]-3-methylbutan-2-one
CID 91316083
2-methanimidoyl-4-(4-methylphenyl)aniline
CID 145157204
ethane;2-methanimidoyl-4-methylaniline;4-methylpyridine
CID 143786948
4-(2-methanimidoyl-4-methylanilino)butanenitrile
CID 144928821
4-methanimidoyl-3-N-(3-methylphenyl)benzene-1,3-diamine
CID 155713764
(2-diazenyl-5-methylphenyl)cyanamide
CID 134239280

Frequently Asked Questions

What is the IUPAC name of N-(2-methanimidoyl-5-methylphenyl)ethanimine?
The IUPAC name of N-(2-methanimidoyl-5-methylphenyl)ethanimine (CID 118350033) is N-(2-methanimidoyl-5-methylphenyl)ethanimine.
What is the SMILES notation for N-(2-methanimidoyl-5-methylphenyl)ethanimine?
The canonical SMILES for N-(2-methanimidoyl-5-methylphenyl)ethanimine is [H]/N=C/c1ccc(C)cc1/N=C/C.
What is the InChIKey of N-(2-methanimidoyl-5-methylphenyl)ethanimine?
The InChIKey is CSRJJJNQAJVELO-DTGJFCPMSA-N. The full InChI is InChI=1S/C10H12N2/c1-3-12-10-6-8(2)4-5-9(10)7-11/h3-7,11H,1-2H3/b11-7+,12-3+.
What are the key properties of N-(2-methanimidoyl-5-methylphenyl)ethanimine?
N-(2-methanimidoyl-5-methylphenyl)ethanimine has a molecular weight of 160.22 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methanimidoyl-5-methylphenyl)ethanimine is sourced from PubChem (CID 118350033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).