N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide

C19H22N2 — CID 143756713

IUPACN-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide
SMILESC=C(C)c1ccc(C)c(/N=C(\C)Nc2ccc(C)cc2)c1
InChIInChI=1S/C19H22N2/c1-13(2)17-9-8-15(4)19(12-17)21-16(5)20-18-10-6-14(3)7-11-18/h6-12H,1H2,2-5H3,(H,20,21)
InChIKeyXESZNAZDGCFPOB-UHFFFAOYSA-N
MW278.40 g/mol
LogP5.50
Rot. Bonds3

About N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide

N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide (PubChem CID 143756713) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide
PubChem CID143756713
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC NameN-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide
SMILESC=C(C)c1ccc(C)c(/N=C(\C)Nc2ccc(C)cc2)c1
InChIInChI=1S/C19H22N2/c1-13(2)17-9-8-15(4)19(12-17)21-16(5)20-18-10-6-14(3)7-11-18/h6-12H,1H2,2-5H3,(H,20,21)
InChIKeyXESZNAZDGCFPOB-UHFFFAOYSA-N
XLogP5.50
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.40
LogP ≤ 55.50
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'}

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Related Compounds

1-methyl-4-prop-1-en-2-ylbenzene;1,2,4-trimethylbenzene
CID 143923034
N-(4-methylphenyl)-5-prop-1-en-2-ylpyridine-2-carboxamide
CID 123868777
N'-(2-methylphenyl)-N-(4-methylphenyl)benzenecarboximidamide
CID 3332745
3,4-dimethyl-N-(4-methylphenyl)benzamide
CID 3950718
N'-(2,5-dimethylphenyl)-N-(4-methylphenyl)oxamide
CID 44995959
cyclobutane;ethane;1-methyl-4-prop-1-en-2-ylbenzene
CID 177043562
CID 91125880
CID 91125880
3-methoxy-4-methyl-N-(4-methylphenyl)benzamide
CID 9071746
N-(methylideneamino)methanamine;1-methyl-4-prop-1-en-2-yl-2-prop-1-en-2-ylsulfanylbenzene
CID 170733991
N-(4-methylphenyl)acetamide
CID 7684
3-(3,4-dimethylanilino)-1-(4-methylphenyl)but-3-en-1-one
CID 2290990
3-(2,5-dimethylphenyl)imino-4-hydroxypent-4-en-2-one
CID 142909705

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide?
The IUPAC name of N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide (CID 143756713) is N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide.
What is the SMILES notation for N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide?
The canonical SMILES for N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide is C=C(C)c1ccc(C)c(/N=C(\C)Nc2ccc(C)cc2)c1.
What is the InChIKey of N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide?
The InChIKey is XESZNAZDGCFPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-13(2)17-9-8-15(4)19(12-17)21-16(5)20-18-10-6-14(3)7-11-18/h6-12H,1H2,2-5H3,(H,20,21).
What are the key properties of N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide?
N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide has a molecular weight of 278.40 g/mol, XLogP of 5.50, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N'-(2-methyl-5-prop-1-en-2-ylphenyl)ethanimidamide is sourced from PubChem (CID 143756713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).