N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide

C17H18N2 — CID 70178542

IUPACN'-(2-ethylphenyl)-N-phenylprop-2-enimidamide
SMILESC=C/C(=N\c1ccccc1CC)Nc1ccccc1
InChIInChI=1S/C17H18N2/c1-3-14-10-8-9-13-16(14)19-17(4-2)18-15-11-6-5-7-12-15/h4-13H,2-3H2,1H3,(H,18,19)
InChIKeyZFOIYRULEZRWCT-UHFFFAOYSA-N
MW250.34 g/mol
LogP4.58
Rot. Bonds4

About N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide

N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide (PubChem CID 70178542) has the molecular formula C17H18N2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide.

Molecular Properties

Compound NameN'-(2-ethylphenyl)-N-phenylprop-2-enimidamide
PubChem CID70178542
Molecular FormulaC17H18N2
Molecular Weight250.34 g/mol
Exact Mass250.15
IUPAC NameN'-(2-ethylphenyl)-N-phenylprop-2-enimidamide
SMILESC=C/C(=N\c1ccccc1CC)Nc1ccccc1
InChIInChI=1S/C17H18N2/c1-3-14-10-8-9-13-16(14)19-17(4-2)18-15-11-6-5-7-12-15/h4-13H,2-3H2,1H3,(H,18,19)
InChIKeyZFOIYRULEZRWCT-UHFFFAOYSA-N
XLogP4.58
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 54.58
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

Di-o-tolylguanidine
CID 7333
Antazoline
CID 2200
Antazoline Hydrochloride
CID 17275
Ethanimidamide, N,N'-diphenyl-
CID 12117
Methanimidamide, N,N'-bis(2,4-dimethylphenyl)-
CID 578703
Guanidine, N,N'-bis(methylphenyl)-
CID 41011
2-Methylquinazoline-4-thiol
CID 727351
Dazepinil Hydrochloride
CID 11954359
N,N'-Bis-(4-hexyl-phenyl)-guanidine
CID 9821194
N,N'-Bis-(4-butyl-phenyl)-guanidine
CID 10496171
N,N'-Bis-(4-sec-butyl-phenyl)-guanidine
CID 10526122
N,N'-Bis-(4-isopropyl-phenyl)-guanidine
CID 13781937

Frequently Asked Questions

What is the IUPAC name of N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide?
The IUPAC name of N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide (CID 70178542) is N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide.
What is the SMILES notation for N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide?
The canonical SMILES for N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide is C=C/C(=N\c1ccccc1CC)Nc1ccccc1.
What is the InChIKey of N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide?
The InChIKey is ZFOIYRULEZRWCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2/c1-3-14-10-8-9-13-16(14)19-17(4-2)18-15-11-6-5-7-12-15/h4-13H,2-3H2,1H3,(H,18,19).
What are the key properties of N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide?
N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide has a molecular weight of 250.34 g/mol, XLogP of 4.58, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-ethylphenyl)-N-phenylprop-2-enimidamide is sourced from PubChem (CID 70178542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).