N'-(benzhydrylideneamino)ethanimidamide

C15H15N3 — CID 11128320

IUPACN'-(benzhydrylideneamino)ethanimidamide
SMILESC/C(N)=N/N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3/c1-12(16)17-18-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H3,(H2,16,17)
InChIKeyFPHCVQTYECSTRW-UHFFFAOYSA-N
MW237.31 g/mol
LogP2.82
Rot. Bonds3

About N'-(benzhydrylideneamino)ethanimidamide

N'-(benzhydrylideneamino)ethanimidamide (PubChem CID 11128320) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is N'-(benzhydrylideneamino)ethanimidamide.

Molecular Properties

Compound NameN'-(benzhydrylideneamino)ethanimidamide
PubChem CID11128320
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC NameN'-(benzhydrylideneamino)ethanimidamide
SMILESC/C(N)=N/N=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15N3/c1-12(16)17-18-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H3,(H2,16,17)
InChIKeyFPHCVQTYECSTRW-UHFFFAOYSA-N
XLogP2.82
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of N'-(benzhydrylideneamino)ethanimidamide?
The IUPAC name of N'-(benzhydrylideneamino)ethanimidamide (CID 11128320) is N'-(benzhydrylideneamino)ethanimidamide.
What is the SMILES notation for N'-(benzhydrylideneamino)ethanimidamide?
The canonical SMILES for N'-(benzhydrylideneamino)ethanimidamide is C/C(N)=N/N=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N'-(benzhydrylideneamino)ethanimidamide?
The InChIKey is FPHCVQTYECSTRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-12(16)17-18-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H3,(H2,16,17).
What are the key properties of N'-(benzhydrylideneamino)ethanimidamide?
N'-(benzhydrylideneamino)ethanimidamide has a molecular weight of 237.31 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(benzhydrylideneamino)ethanimidamide is sourced from PubChem (CID 11128320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).