4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide

C13H10Cl2N2 — CID 11737167

IUPAC4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide
SMILESN/C(=N\c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C13H10Cl2N2/c14-10-3-1-9(2-4-10)13(16)17-12-7-5-11(15)6-8-12/h1-8H,(H2,16,17)
InChIKeyHASRBBLHBNEQIE-UHFFFAOYSA-N
MW265.14 g/mol
LogP4.03
Rot. Bonds2

About 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide

4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide (PubChem CID 11737167) has the molecular formula C13H10Cl2N2 and a molecular weight of 265.14 g/mol. Its IUPAC name is 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide.

Molecular Properties

Compound Name4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide
PubChem CID11737167
Molecular FormulaC13H10Cl2N2
Molecular Weight265.14 g/mol
Exact Mass264.02
IUPAC Name4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide
SMILESN/C(=N\c1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIInChI=1S/C13H10Cl2N2/c14-10-3-1-9(2-4-10)13(16)17-12-7-5-11(15)6-8-12/h1-8H,(H2,16,17)
InChIKeyHASRBBLHBNEQIE-UHFFFAOYSA-N
XLogP4.03
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.14
LogP ≤ 54.03
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

4-[[4-[[amino-(4-chlorophenyl)methylidene]amino]phenyl]methyl]benzenesulfonic acid
CID 134117835
1-N',4-N'-diphenylbenzene-1,4-dicarboximidamide;dihydrochloride
CID 131872163
2-(4-chlorophenyl)-1-(diaminomethylideneamino)guanidine
CID 69017102
4-chloro-1-N',3-N'-bis[4-(N'-methylcarbamimidoyl)phenyl]benzene-1,3-dicarboximidamide;tetrahydrochloride
CID 131872595
N'-(5-bromo-2-pyridinyl)-4-chlorobenzenecarboximidamide
CID 119056721
[amino-(4-chlorophenyl)methylidene]carbamothioic S-acid;carbamothioic S-acid
CID 174055082
bis(2-(4-chlorophenyl)-1-(diaminomethylidene)guanidine);cyclohexane
CID 70021727
N'-(2-bromo-3-pyridinyl)-4-chlorobenzenecarboximidamide
CID 121002276
N'-(4-chlorophenyl)-2-piperazin-1-ylquinoline-6-carboximidamide
CID 59789927
N'-(4-cyanophenyl)-4-methylbenzenecarboximidamide
CID 12966223
1-carbamimidoyl-1,2-bis(4-chlorophenyl)guanidine
CID 57357482
(Z)-3-amino-N'-(4-chlorophenyl)-2-methylprop-2-enimidamide
CID 89361248

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide?
The IUPAC name of 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide (CID 11737167) is 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide.
What is the SMILES notation for 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide?
The canonical SMILES for 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide is N/C(=N\c1ccc(Cl)cc1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide?
The InChIKey is HASRBBLHBNEQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl2N2/c14-10-3-1-9(2-4-10)13(16)17-12-7-5-11(15)6-8-12/h1-8H,(H2,16,17).
What are the key properties of 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide?
4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide has a molecular weight of 265.14 g/mol, XLogP of 4.03, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N'-(4-chlorophenyl)benzenecarboximidamide is sourced from PubChem (CID 11737167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).