1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine

C15H11Cl2N3 — CID 43381347

IUPAC1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine
SMILESNc1cc(-c2ccccc2)nn1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H11Cl2N3/c16-11-6-7-14(12(17)8-11)20-15(18)9-13(19-20)10-4-2-1-3-5-10/h1-9H,18H2
InChIKeyNYAXAUPAPVDHHA-UHFFFAOYSA-N
MW304.18 g/mol
LogP4.43
Rot. Bonds2

About 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine

1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine (PubChem CID 43381347) has the molecular formula C15H11Cl2N3 and a molecular weight of 304.18 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine
PubChem CID43381347
Molecular FormulaC15H11Cl2N3
Molecular Weight304.18 g/mol
Exact Mass303.03
IUPAC Name1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine
SMILESNc1cc(-c2ccccc2)nn1-c1ccc(Cl)cc1Cl
InChIInChI=1S/C15H11Cl2N3/c16-11-6-7-14(12(17)8-11)20-15(18)9-13(19-20)10-4-2-1-3-5-10/h1-9H,18H2
InChIKeyNYAXAUPAPVDHHA-UHFFFAOYSA-N
XLogP4.43
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.18
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-bromophenyl)-3-(4-chlorophenyl)pyrazol-5-amine
CID 43542919
3-(3,5-dichlorophenyl)-1-phenylpyrazol-5-amine
CID 43336748
3-(4-chlorophenyl)-1-(2,4-dichlorophenyl)pyrazole-5-carboxylic acid
CID 171559503
3-(4-chlorophenyl)-1-pyridin-2-ylpyrazol-5-amine
CID 43381333
3-(4-chlorophenyl)-1-(4-fluoro-2-methylphenyl)pyrazol-5-amine
CID 63860690
2-(2,4-dichlorophenyl)-4-methylphthalazin-1-one
CID 745846
2-[1-(2,4-dichlorophenyl)-3,5-diphenylpyrazol-4-yl]acetic acid
CID 20542736
1-(2,4-dichlorophenyl)-5-phenylpyrazole-3-carboxylate
CID 6986761
3-(4-iodophenyl)-1-phenylpyrazol-5-amine
CID 43336728
3-(3-chlorophenyl)-1-(3,5-dimethylphenyl)pyrazol-5-amine
CID 43542636
3-(3-bromo-4-chlorophenyl)-1-phenylpyrazol-5-amine
CID 107988579
3-(3-chloro-4-methylphenyl)-1-phenylpyrazol-5-amine
CID 63195160

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine?
The IUPAC name of 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine (CID 43381347) is 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine?
The canonical SMILES for 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine is Nc1cc(-c2ccccc2)nn1-c1ccc(Cl)cc1Cl.
What is the InChIKey of 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine?
The InChIKey is NYAXAUPAPVDHHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N3/c16-11-6-7-14(12(17)8-11)20-15(18)9-13(19-20)10-4-2-1-3-5-10/h1-9H,18H2.
What are the key properties of 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine?
1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine has a molecular weight of 304.18 g/mol, XLogP of 4.43, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-3-phenylpyrazol-5-amine is sourced from PubChem (CID 43381347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).