3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine

C14H10Cl2N4 — CID 43543157

IUPAC3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine
SMILESNc1cc(-c2ccc(Cl)cc2Cl)nn1-c1ccncc1
InChIInChI=1S/C14H10Cl2N4/c15-9-1-2-11(12(16)7-9)13-8-14(17)20(19-13)10-3-5-18-6-4-10/h1-8H,17H2
InChIKeyZCBPXAAUSHPSAH-UHFFFAOYSA-N
MW305.17 g/mol
LogP3.82
Rot. Bonds2

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

3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine (PubChem CID 43543157) has the molecular formula C14H10Cl2N4 and a molecular weight of 305.17 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine
PubChem CID43543157
Molecular FormulaC14H10Cl2N4
Molecular Weight305.17 g/mol
Exact Mass304.03
IUPAC Name3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine
SMILESNc1cc(-c2ccc(Cl)cc2Cl)nn1-c1ccncc1
InChIInChI=1S/C14H10Cl2N4/c15-9-1-2-11(12(16)7-9)13-8-14(17)20(19-13)10-3-5-18-6-4-10/h1-8H,17H2
InChIKeyZCBPXAAUSHPSAH-UHFFFAOYSA-N
XLogP3.82
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.17
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine?
The IUPAC name of 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine (CID 43543157) is 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine?
The canonical SMILES for 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine is Nc1cc(-c2ccc(Cl)cc2Cl)nn1-c1ccncc1.
What is the InChIKey of 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine?
The InChIKey is ZCBPXAAUSHPSAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N4/c15-9-1-2-11(12(16)7-9)13-8-14(17)20(19-13)10-3-5-18-6-4-10/h1-8H,17H2.
What are the key properties of 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine?
3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine has a molecular weight of 305.17 g/mol, XLogP of 3.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-1-pyridin-4-ylpyrazol-5-amine is sourced from PubChem (CID 43543157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).