4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine

C18H18N4O2 — CID 23794706

IUPAC4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine
SMILESCOc1ccc(-c2ccc(C=Nn3cc(OC)c(N)n3)cc2)cc1
InChIInChI=1S/C18H18N4O2/c1-23-16-9-7-15(8-10-16)14-5-3-13(4-6-14)11-20-22-12-17(24-2)18(19)21-22/h3-12H,1-2H3,(H2,19,21)
InChIKeyPPBZAJPZQRVJIL-UHFFFAOYSA-N
MW322.37 g/mol
LogP3.03
Rot. Bonds5

About 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine

4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine (PubChem CID 23794706) has the molecular formula C18H18N4O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine.

Molecular Properties

Compound Name4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine
PubChem CID23794706
Molecular FormulaC18H18N4O2
Molecular Weight322.37 g/mol
Exact Mass322.14
IUPAC Name4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine
SMILESCOc1ccc(-c2ccc(C=Nn3cc(OC)c(N)n3)cc2)cc1
InChIInChI=1S/C18H18N4O2/c1-23-16-9-7-15(8-10-16)14-5-3-13(4-6-14)11-20-22-12-17(24-2)18(19)21-22/h3-12H,1-2H3,(H2,19,21)
InChIKeyPPBZAJPZQRVJIL-UHFFFAOYSA-N
XLogP3.03
TPSA74.66 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-methoxyphenyl)-1-[(Z)-(4-methoxyphenyl)methylideneamino]imidazol-2-amine
CID 5403460
1-(4-methoxyphenyl)-N-(1,2,4-triazol-4-yl)methanimine
CID 759377
1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
CID 54482883
1-[(6-methoxynaphthalen-2-yl)methylideneamino]-4-methylimidazol-2-amine
CID 168628492
(Z)-1-(4-methoxyphenyl)-N-oxidomethanimine
CID 11389669
1-[(E)-(4-methoxyphenyl)methylideneamino]benzimidazol-2-amine
CID 6858525
(E)-1-(4-methoxyphenyl)-N-(3-methylsulfanyl-1,2,4-triazol-4-yl)methanimine
CID 6858814
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307
N-methoxy-1-(4-methoxyphenyl)methanimine
CID 520640
1-(4-fluorophenyl)-N-[4-(4-methoxyphenyl)phenyl]methanimine
CID 821942
3-(4-fluorophenyl)-4-[(E)-(4-methoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione
CID 6859156
4-[[1,3-bis(4-methoxyphenyl)-5,6-dimethylisoindol-2-yl]iminomethyl]-N,N-bis(4-methoxyphenyl)aniline
CID 58391718

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine?
The IUPAC name of 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine (CID 23794706) is 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine.
What is the SMILES notation for 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine?
The canonical SMILES for 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine is COc1ccc(-c2ccc(C=Nn3cc(OC)c(N)n3)cc2)cc1.
What is the InChIKey of 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine?
The InChIKey is PPBZAJPZQRVJIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O2/c1-23-16-9-7-15(8-10-16)14-5-3-13(4-6-14)11-20-22-12-17(24-2)18(19)21-22/h3-12H,1-2H3,(H2,19,21).
What are the key properties of 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine?
4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine has a molecular weight of 322.37 g/mol, XLogP of 3.03, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-[[4-(4-methoxyphenyl)phenyl]methylideneamino]pyrazol-3-amine is sourced from PubChem (CID 23794706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).