3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine

C15H12Cl2N4 — CID 2483894

IUPAC3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine
SMILESCc1cc(Nc2ncc(Cl)cc2Cl)n(-c2ccccc2)n1
InChIInChI=1S/C15H12Cl2N4/c1-10-7-14(19-15-13(17)8-11(16)9-18-15)21(20-10)12-5-3-2-4-6-12/h2-9H,1H3,(H,18,19)
InChIKeyWYPADKGCSMFVPQ-UHFFFAOYSA-N
MW319.20 g/mol
LogP4.63
Rot. Bonds3

About 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine

3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine (PubChem CID 2483894) has the molecular formula C15H12Cl2N4 and a molecular weight of 319.20 g/mol. Its IUPAC name is 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine
PubChem CID2483894
Molecular FormulaC15H12Cl2N4
Molecular Weight319.20 g/mol
Exact Mass318.04
IUPAC Name3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine
SMILESCc1cc(Nc2ncc(Cl)cc2Cl)n(-c2ccccc2)n1
InChIInChI=1S/C15H12Cl2N4/c1-10-7-14(19-15-13(17)8-11(16)9-18-15)21(20-10)12-5-3-2-4-6-12/h2-9H,1H3,(H,18,19)
InChIKeyWYPADKGCSMFVPQ-UHFFFAOYSA-N
XLogP4.63
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.20
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine (CID 2483894) is 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine is Cc1cc(Nc2ncc(Cl)cc2Cl)n(-c2ccccc2)n1.
What is the InChIKey of 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine?
The InChIKey is WYPADKGCSMFVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12Cl2N4/c1-10-7-14(19-15-13(17)8-11(16)9-18-15)21(20-10)12-5-3-2-4-6-12/h2-9H,1H3,(H,18,19).
What are the key properties of 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine?
3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine has a molecular weight of 319.20 g/mol, XLogP of 4.63, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(5-methyl-2-phenylpyrazol-3-yl)pyridin-2-amine is sourced from PubChem (CID 2483894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).