3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine

C15H17N5O — CID 83208395

IUPAC3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine
SMILESCOc1ccccc1-n1cc(N)c(-c2cn(C)nc2C)n1
InChIInChI=1S/C15H17N5O/c1-10-11(8-19(2)17-10)15-12(16)9-20(18-15)13-6-4-5-7-14(13)21-3/h4-9H,16H2,1-3H3
InChIKeyFQDRFWLCSRZLFC-UHFFFAOYSA-N
MW283.34 g/mol
LogP2.17
Rot. Bonds3

About 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine

3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine (PubChem CID 83208395) has the molecular formula C15H17N5O and a molecular weight of 283.34 g/mol. Its IUPAC name is 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine.

Molecular Properties

Compound Name3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine
PubChem CID83208395
Molecular FormulaC15H17N5O
Molecular Weight283.34 g/mol
Exact Mass283.14
IUPAC Name3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine
SMILESCOc1ccccc1-n1cc(N)c(-c2cn(C)nc2C)n1
InChIInChI=1S/C15H17N5O/c1-10-11(8-19(2)17-10)15-12(16)9-20(18-15)13-6-4-5-7-14(13)21-3/h4-9H,16H2,1-3H3
InChIKeyFQDRFWLCSRZLFC-UHFFFAOYSA-N
XLogP2.17
TPSA70.89 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine?
The IUPAC name of 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine (CID 83208395) is 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine.
What is the SMILES notation for 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine?
The canonical SMILES for 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine is COc1ccccc1-n1cc(N)c(-c2cn(C)nc2C)n1.
What is the InChIKey of 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine?
The InChIKey is FQDRFWLCSRZLFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O/c1-10-11(8-19(2)17-10)15-12(16)9-20(18-15)13-6-4-5-7-14(13)21-3/h4-9H,16H2,1-3H3.
What are the key properties of 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine?
3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine has a molecular weight of 283.34 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-dimethylpyrazol-4-yl)-1-(2-methoxyphenyl)pyrazol-4-amine is sourced from PubChem (CID 83208395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).