4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine

C17H16N4 — CID 168628686

IUPAC4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine
SMILESCc1cn(N=Cc2ccccc2-c2ccccc2)c(N)n1
InChIInChI=1S/C17H16N4/c1-13-12-21(17(18)20-13)19-11-15-9-5-6-10-16(15)14-7-3-2-4-8-14/h2-12H,1H3,(H2,18,20)
InChIKeyGYFHLTDVWRZHEP-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.32
Rot. Bonds3

About 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine

4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine (PubChem CID 168628686) has the molecular formula C17H16N4 and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine
PubChem CID168628686
Molecular FormulaC17H16N4
Molecular Weight276.34 g/mol
Exact Mass276.14
IUPAC Name4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine
SMILESCc1cn(N=Cc2ccccc2-c2ccccc2)c(N)n1
InChIInChI=1S/C17H16N4/c1-13-12-21(17(18)20-13)19-11-15-9-5-6-10-16(15)14-7-3-2-4-8-14/h2-12H,1H3,(H2,18,20)
InChIKeyGYFHLTDVWRZHEP-UHFFFAOYSA-N
XLogP3.32
TPSA56.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

methyl 3-[2-[(2-amino-4-methylimidazol-1-yl)iminomethyl]phenyl]benzoate
CID 168629487
1-[(2-cyclopropylphenyl)methylideneamino]-4-methylimidazol-2-amine
CID 168629566
2-[2-[4-[(2-amino-4-methylimidazol-1-yl)iminomethyl]phenyl]phenyl]acetic acid
CID 168629245
4-methyl-1-[(2-propylsulfanylphenyl)methylideneamino]imidazol-2-amine
CID 168628990
1-[[2-(azepan-1-ylmethyl)phenyl]methylideneamino]-4-methylimidazol-2-amine
CID 168629078
[2-[(2-amino-4-methylimidazol-1-yl)iminomethyl]phenyl] acetate
CID 168631323
2-[3-[(2-amino-4-methylimidazol-1-yl)iminomethyl]phenyl]benzoic acid
CID 168631010
4-methyl-1-[(2-piperazin-1-ylphenyl)methylideneamino]imidazol-2-amine
CID 168631043
4-methyl-1-[(2-pentoxyphenyl)methylideneamino]imidazol-2-amine
CID 168628888
4-methyl-1-[(2-phenylquinolin-7-yl)methylideneamino]imidazol-2-amine
CID 168629687
1-[[2-(4-benzylpiperazin-1-yl)phenyl]methylideneamino]-4-methylimidazol-2-amine
CID 168629658
4-methyl-1-[[4-(N-methylanilino)phenyl]methylideneamino]imidazol-2-amine
CID 168628875

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine?
The IUPAC name of 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine (CID 168628686) is 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine.
What is the SMILES notation for 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine?
The canonical SMILES for 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine is Cc1cn(N=Cc2ccccc2-c2ccccc2)c(N)n1.
What is the InChIKey of 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine?
The InChIKey is GYFHLTDVWRZHEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4/c1-13-12-21(17(18)20-13)19-11-15-9-5-6-10-16(15)14-7-3-2-4-8-14/h2-12H,1H3,(H2,18,20).
What are the key properties of 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine?
4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine has a molecular weight of 276.34 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[(2-phenylphenyl)methylideneamino]imidazol-2-amine is sourced from PubChem (CID 168628686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).