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

C14H11Cl2N5 — CID 2999524

IUPAC3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine
SMILESCc1cc(Nc2ncc(Cl)cc2Cl)n(-c2ccccn2)n1
InChIInChI=1S/C14H11Cl2N5/c1-9-6-13(19-14-11(16)7-10(15)8-18-14)21(20-9)12-4-2-3-5-17-12/h2-8H,1H3,(H,18,19)
InChIKeyWRKOUKXWWLEFMC-UHFFFAOYSA-N
MW320.18 g/mol
LogP4.02
Rot. Bonds3

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

3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine (PubChem CID 2999524) has the molecular formula C14H11Cl2N5 and a molecular weight of 320.18 g/mol. Its IUPAC name is 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine
PubChem CID2999524
Molecular FormulaC14H11Cl2N5
Molecular Weight320.18 g/mol
Exact Mass319.04
IUPAC Name3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine
SMILESCc1cc(Nc2ncc(Cl)cc2Cl)n(-c2ccccn2)n1
InChIInChI=1S/C14H11Cl2N5/c1-9-6-13(19-14-11(16)7-10(15)8-18-14)21(20-9)12-4-2-3-5-17-12/h2-8H,1H3,(H,18,19)
InChIKeyWRKOUKXWWLEFMC-UHFFFAOYSA-N
XLogP4.02
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.18
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine?
The IUPAC name of 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine (CID 2999524) is 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine?
The canonical SMILES for 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine is Cc1cc(Nc2ncc(Cl)cc2Cl)n(-c2ccccn2)n1.
What is the InChIKey of 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine?
The InChIKey is WRKOUKXWWLEFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2N5/c1-9-6-13(19-14-11(16)7-10(15)8-18-14)21(20-9)12-4-2-3-5-17-12/h2-8H,1H3,(H,18,19).
What are the key properties of 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine?
3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine has a molecular weight of 320.18 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-(5-methyl-2-pyridin-2-ylpyrazol-3-yl)pyridin-2-amine is sourced from PubChem (CID 2999524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).