2,2-diphenylethanimidamide;dihydrochloride

C14H16Cl2N2 — CID 172782287

IUPAC2,2-diphenylethanimidamide;dihydrochloride
SMILESCl.Cl.[H]/N=C(\N)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H14N2.2ClH/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h1-10,13H,(H3,15,16);2*1H
InChIKeyOKODQTJIILPSPP-UHFFFAOYSA-N
MW283.20 g/mol
LogP3.60
Rot. Bonds3

About 2,2-diphenylethanimidamide;dihydrochloride

2,2-diphenylethanimidamide;dihydrochloride (PubChem CID 172782287) has the molecular formula C14H16Cl2N2 and a molecular weight of 283.20 g/mol. Its IUPAC name is 2,2-diphenylethanimidamide;dihydrochloride.

Molecular Properties

Compound Name2,2-diphenylethanimidamide;dihydrochloride
PubChem CID172782287
Molecular FormulaC14H16Cl2N2
Molecular Weight283.20 g/mol
Exact Mass282.07
IUPAC Name2,2-diphenylethanimidamide;dihydrochloride
SMILESCl.Cl.[H]/N=C(\N)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C14H14N2.2ClH/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h1-10,13H,(H3,15,16);2*1H
InChIKeyOKODQTJIILPSPP-UHFFFAOYSA-N
XLogP3.60
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.20
LogP ≤ 53.60
H-Bond Donors ≤ 52
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

2-(3,5-dibromopyrazin-2-yl)-2-phenylethanimidamide
CID 175691513
2-[4-(2-amino-2-imino-1-phenoxyethyl)phenyl]-2-phenoxyethanimidamide;dihydrochloride
CID 175108537
2-[3-(2-amino-2-imino-1-phenoxyethyl)phenyl]-2-phenoxyethanimidamide
CID 175114234
3-phenylbutanimidamide;hydrochloride
CID 69158161
3-tert-butylsulfanyl-2-phenylpropanimidamide
CID 64536103
3,3-diphenylprop-1-ene-1,2-diamine
CID 174998298
benzenecarboximidamide;sulfane
CID 172701796
2-methyl-4-phenylbutanimidamide;hydrochloride
CID 175069791
2-fluoro-3-phenylpropanimidamide
CID 18356520
3-(dibutylamino)-2-phenylpropanimidamide
CID 64537683
3-[methyl(3-methylbutan-2-yl)amino]-2-phenylpropanimidamide
CID 64538702
3-(3-hydroxybutan-2-ylsulfanyl)-2-phenylpropanimidamide
CID 107770788

Frequently Asked Questions

What is the IUPAC name of 2,2-diphenylethanimidamide;dihydrochloride?
The IUPAC name of 2,2-diphenylethanimidamide;dihydrochloride (CID 172782287) is 2,2-diphenylethanimidamide;dihydrochloride.
What is the SMILES notation for 2,2-diphenylethanimidamide;dihydrochloride?
The canonical SMILES for 2,2-diphenylethanimidamide;dihydrochloride is Cl.Cl.[H]/N=C(\N)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2,2-diphenylethanimidamide;dihydrochloride?
The InChIKey is OKODQTJIILPSPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2.2ClH/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h1-10,13H,(H3,15,16);2*1H.
What are the key properties of 2,2-diphenylethanimidamide;dihydrochloride?
2,2-diphenylethanimidamide;dihydrochloride has a molecular weight of 283.20 g/mol, XLogP of 3.60, 3 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diphenylethanimidamide;dihydrochloride is sourced from PubChem (CID 172782287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).