1,2-bis(1-phenylethylideneamino)guanidine

C17H19N5 — CID 145026276

IUPAC1,2-bis(1-phenylethylideneamino)guanidine
SMILESCC(=N/N=C(/N)NN=C(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N5/c1-13(15-9-5-3-6-10-15)19-21-17(18)22-20-14(2)16-11-7-4-8-12-16/h3-12H,1-2H3,(H3,18,21,22)
InChIKeyPSYDJAOGDPDYGJ-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.74
Rot. Bonds4

About 1,2-bis(1-phenylethylideneamino)guanidine

1,2-bis(1-phenylethylideneamino)guanidine (PubChem CID 145026276) has the molecular formula C17H19N5 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1,2-bis(1-phenylethylideneamino)guanidine.

Molecular Properties

Compound Name1,2-bis(1-phenylethylideneamino)guanidine
PubChem CID145026276
Molecular FormulaC17H19N5
Molecular Weight293.37 g/mol
Exact Mass293.16
IUPAC Name1,2-bis(1-phenylethylideneamino)guanidine
SMILESCC(=N/N=C(/N)NN=C(C)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19N5/c1-13(15-9-5-3-6-10-15)19-21-17(18)22-20-14(2)16-11-7-4-8-12-16/h3-12H,1-2H3,(H3,18,21,22)
InChIKeyPSYDJAOGDPDYGJ-UHFFFAOYSA-N
XLogP2.74
TPSA75.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-phenyl-1-[(E)-1-phenylethylideneamino]guanidine
CID 13451380
1,2,3-tris(1-phenylethylideneamino)guanidine
CID 5226187
1,2-bis[1-(4-chlorophenyl)ethylideneamino]guanidine;hydrochloride
CID 74961259
1,2-bis[1-(4-tert-butylphenyl)ethylideneamino]guanidine
CID 123753114
1,2-bis[1-(4-tert-butylphenyl)ethylideneamino]guanidine;hydrochloride
CID 140813770
(1-phenylethylideneamino)thiourea
CID 912962
CID 127025281
CID 127025281
1,2-bis[(2-amino-1-phenylethylidene)amino]guanidine
CID 140813812
[(Z)-1-(4-phenylphenyl)ethylideneamino]thiourea
CID 5392292
2-[(E)-1-(4-phenylphenyl)ethylideneamino]guanidine;hydrochloride
CID 54612215
4-oxo-4-[2-(1-phenylethylidene)hydrazinyl]but-2-enoic acid
CID 3074623
N-[(Z)-1-phenylethylideneamino]cyclopropanecarboxamide
CID 5420065

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(1-phenylethylideneamino)guanidine?
The IUPAC name of 1,2-bis(1-phenylethylideneamino)guanidine (CID 145026276) is 1,2-bis(1-phenylethylideneamino)guanidine.
What is the SMILES notation for 1,2-bis(1-phenylethylideneamino)guanidine?
The canonical SMILES for 1,2-bis(1-phenylethylideneamino)guanidine is CC(=N/N=C(/N)NN=C(C)c1ccccc1)c1ccccc1.
What is the InChIKey of 1,2-bis(1-phenylethylideneamino)guanidine?
The InChIKey is PSYDJAOGDPDYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5/c1-13(15-9-5-3-6-10-15)19-21-17(18)22-20-14(2)16-11-7-4-8-12-16/h3-12H,1-2H3,(H3,18,21,22).
What are the key properties of 1,2-bis(1-phenylethylideneamino)guanidine?
1,2-bis(1-phenylethylideneamino)guanidine has a molecular weight of 293.37 g/mol, XLogP of 2.74, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(1-phenylethylideneamino)guanidine is sourced from PubChem (CID 145026276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).