4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine

C13H17N3O2 — CID 117370777

IUPAC4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
SMILESCOc1cc(-c2cnn(C)c2N)cc(OC)c1C
InChIInChI=1S/C13H17N3O2/c1-8-11(17-3)5-9(6-12(8)18-4)10-7-15-16(2)13(10)14/h5-7H,14H2,1-4H3
InChIKeyFEFWPQGPKCFOSY-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.99
Rot. Bonds3

About 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine

4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine (PubChem CID 117370777) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
PubChem CID117370777
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
SMILESCOc1cc(-c2cnn(C)c2N)cc(OC)c1C
InChIInChI=1S/C13H17N3O2/c1-8-11(17-3)5-9(6-12(8)18-4)10-7-15-16(2)13(10)14/h5-7H,14H2,1-4H3
InChIKeyFEFWPQGPKCFOSY-UHFFFAOYSA-N
XLogP1.99
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-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-[3,5-dimethoxy-4-(methoxymethyl)phenyl]-1-methylpyrazol-5-amine
CID 117444289
4-(3-fluoro-5-methoxy-4-propan-2-ylphenyl)-1-methylpyrazol-5-amine
CID 117412665
5-(5-amino-1-methylpyrazol-4-yl)-2,3-dimethoxybenzonitrile
CID 117399239
4-(3-chloro-2,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine
CID 117452245
4-(7-methoxy-1-benzofuran-5-yl)-1-methylpyrazol-5-amine
CID 117359622
4-(2,3-dimethoxy-5,6-dimethylphenyl)-1-methylpyrazol-5-amine
CID 117407767
4-(3-bromo-6-methoxy-2-methylphenyl)-1-methylpyrazol-5-amine
CID 117477177
4-(3-fluoro-5-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117315496
4-(3,4-dimethylphenyl)-1-methylpyrazol-5-amine
CID 62901487
5-(5-amino-1-methylpyrazol-4-yl)-4-methoxy-2-methylphenol
CID 117338196
4-(3-cyclohexyl-4-methoxyphenyl)-1-methylpyrazol-5-amine
CID 117459944
4-(4-chloro-2,5-dimethoxyphenyl)-1-methylpyrazol-5-amine
CID 117422678

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine (CID 117370777) is 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine is COc1cc(-c2cnn(C)c2N)cc(OC)c1C.
What is the InChIKey of 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine?
The InChIKey is FEFWPQGPKCFOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-8-11(17-3)5-9(6-12(8)18-4)10-7-15-16(2)13(10)14/h5-7H,14H2,1-4H3.
What are the key properties of 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine?
4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine has a molecular weight of 247.30 g/mol, XLogP of 1.99, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethoxy-4-methylphenyl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 117370777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).