5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine

C12H15N3O — CID 116827490

IUPAC5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine
SMILESCNc1cc(-c2ccccc2OC)n(C)n1
InChIInChI=1S/C12H15N3O/c1-13-12-8-10(15(2)14-12)9-6-4-5-7-11(9)16-3/h4-8H,1-3H3,(H,13,14)
InChIKeyOVNKZVXFESYBNJ-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.14
Rot. Bonds3

About 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine

5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine (PubChem CID 116827490) has the molecular formula C12H15N3O and a molecular weight of 217.27 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine
PubChem CID116827490
Molecular FormulaC12H15N3O
Molecular Weight217.27 g/mol
Exact Mass217.12
IUPAC Name5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine
SMILESCNc1cc(-c2ccccc2OC)n(C)n1
InChIInChI=1S/C12H15N3O/c1-13-12-8-10(15(2)14-12)9-6-4-5-7-11(9)16-3/h4-8H,1-3H3,(H,13,14)
InChIKeyOVNKZVXFESYBNJ-UHFFFAOYSA-N
XLogP2.14
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-bis(2-methoxyphenyl)-1-methylpyrazole
CID 19586953
5-(2,4-dimethoxy-3-methylphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827447
methyl 5-(2-methoxyphenyl)-1-methylpyrazole-3-carboxylate
CID 62267837
5-(5-chloro-2-methoxy-4-methylphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827428
1-[5-(2-methoxyphenyl)-1-methylpyrazol-3-yl]ethanone
CID 82128496
5-(3-fluoro-4-methoxyphenyl)-N,1-dimethylpyrazol-3-amine
CID 116827395
N-(2,6-difluorophenyl)-5-(2-methoxyphenyl)-1-methylpyrazole-3-carboxamide
CID 90271579
N,1-dimethyl-5-(4-methylphenyl)pyrazol-3-amine
CID 116827378
2-(2-methoxyphenyl)-1-methylpyrrole
CID 124706207
N-cyclopropyl-5-(2-methoxy-5-methylphenyl)-1-methylpyrazol-3-amine
CID 116827533
6-tert-butyl-2-(2-methoxyphenyl)-N-methylpyrimidin-4-amine
CID 62192683
6-(2-methoxyphenyl)-N-methyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769157

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine?
The IUPAC name of 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine (CID 116827490) is 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine.
What is the SMILES notation for 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine?
The canonical SMILES for 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine is CNc1cc(-c2ccccc2OC)n(C)n1.
What is the InChIKey of 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine?
The InChIKey is OVNKZVXFESYBNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O/c1-13-12-8-10(15(2)14-12)9-6-4-5-7-11(9)16-3/h4-8H,1-3H3,(H,13,14).
What are the key properties of 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine?
5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine has a molecular weight of 217.27 g/mol, XLogP of 2.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-N,1-dimethylpyrazol-3-amine is sourced from PubChem (CID 116827490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).