2-(2-formylphenyl)-1-(4-formylphenyl)guanidine

C15H13N3O2 — CID 141046732

IUPAC2-(2-formylphenyl)-1-(4-formylphenyl)guanidine
SMILESN/C(=N\c1ccccc1C=O)Nc1ccc(C=O)cc1
InChIInChI=1S/C15H13N3O2/c16-15(17-13-7-5-11(9-19)6-8-13)18-14-4-2-1-3-12(14)10-20/h1-10H,(H3,16,17,18)
InChIKeyWYZXGNMHGHRPSW-UHFFFAOYSA-N
MW267.29 g/mol
LogP2.37
Rot. Bonds4

About 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine

2-(2-formylphenyl)-1-(4-formylphenyl)guanidine (PubChem CID 141046732) has the molecular formula C15H13N3O2 and a molecular weight of 267.29 g/mol. Its IUPAC name is 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine.

Molecular Properties

Compound Name2-(2-formylphenyl)-1-(4-formylphenyl)guanidine
PubChem CID141046732
Molecular FormulaC15H13N3O2
Molecular Weight267.29 g/mol
Exact Mass267.10
IUPAC Name2-(2-formylphenyl)-1-(4-formylphenyl)guanidine
SMILESN/C(=N\c1ccccc1C=O)Nc1ccc(C=O)cc1
InChIInChI=1S/C15H13N3O2/c16-15(17-13-7-5-11(9-19)6-8-13)18-14-4-2-1-3-12(14)10-20/h1-10H,(H3,16,17,18)
InChIKeyWYZXGNMHGHRPSW-UHFFFAOYSA-N
XLogP2.37
TPSA84.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-(propan-2-ylideneamino)benzaldehyde
CID 135040375
4-N-[4-[(4-formylbenzoyl)amino]phenyl]-1-N-phenylbenzene-1,4-dicarboxamide
CID 144544171
benzaldehyde;N-(4-formylphenyl)acetamide;N-methylmethanamine
CID 87691755
N-(4-formylphenyl)-2-phenylacetamide
CID 56932050
N-(4-formylphenyl)naphthalene-2-carboxamide
CID 87842384
N-(4-formylphenyl)-2-nitrobenzamide
CID 25179247
N-(4-formylphenyl)-2-phenylpropanamide
CID 87347129
N-(4-formylphenyl)-1,3-dihydroisoindole-2-carboxamide
CID 86665079
aminophosphonous acid;benzaldehyde
CID 87549202
N-(4-formylphenyl)-2-methoxy-2-methylpropanamide
CID 106912194
2-(2-ethylphenyl)-1-(3-ethylphenyl)guanidine
CID 10587917
benzene;terephthalaldehyde
CID 163498156

Frequently Asked Questions

What is the IUPAC name of 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine?
The IUPAC name of 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine (CID 141046732) is 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine.
What is the SMILES notation for 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine?
The canonical SMILES for 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine is N/C(=N\c1ccccc1C=O)Nc1ccc(C=O)cc1.
What is the InChIKey of 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine?
The InChIKey is WYZXGNMHGHRPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O2/c16-15(17-13-7-5-11(9-19)6-8-13)18-14-4-2-1-3-12(14)10-20/h1-10H,(H3,16,17,18).
What are the key properties of 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine?
2-(2-formylphenyl)-1-(4-formylphenyl)guanidine has a molecular weight of 267.29 g/mol, XLogP of 2.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-formylphenyl)-1-(4-formylphenyl)guanidine is sourced from PubChem (CID 141046732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).