3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine

C10H10Cl2N4O — CID 114274024

IUPAC3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine
SMILESCNc1nc(-n2cc(OC)cn2)c(Cl)cc1Cl
InChIInChI=1S/C10H10Cl2N4O/c1-13-9-7(11)3-8(12)10(15-9)16-5-6(17-2)4-14-16/h3-5H,1-2H3,(H,13,15)
InChIKeyBZJZWPHXMXXLFV-UHFFFAOYSA-N
MW273.12 g/mol
LogP2.62
Rot. Bonds3

About 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine

3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine (PubChem CID 114274024) has the molecular formula C10H10Cl2N4O and a molecular weight of 273.12 g/mol. Its IUPAC name is 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine
PubChem CID114274024
Molecular FormulaC10H10Cl2N4O
Molecular Weight273.12 g/mol
Exact Mass272.02
IUPAC Name3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine
SMILESCNc1nc(-n2cc(OC)cn2)c(Cl)cc1Cl
InChIInChI=1S/C10H10Cl2N4O/c1-13-9-7(11)3-8(12)10(15-9)16-5-6(17-2)4-14-16/h3-5H,1-2H3,(H,13,15)
InChIKeyBZJZWPHXMXXLFV-UHFFFAOYSA-N
XLogP2.62
TPSA51.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.12
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine?
The IUPAC name of 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine (CID 114274024) is 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine.
What is the SMILES notation for 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine?
The canonical SMILES for 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine is CNc1nc(-n2cc(OC)cn2)c(Cl)cc1Cl.
What is the InChIKey of 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine?
The InChIKey is BZJZWPHXMXXLFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10Cl2N4O/c1-13-9-7(11)3-8(12)10(15-9)16-5-6(17-2)4-14-16/h3-5H,1-2H3,(H,13,15).
What are the key properties of 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine?
3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine has a molecular weight of 273.12 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-6-(4-methoxypyrazol-1-yl)-N-methylpyridin-2-amine is sourced from PubChem (CID 114274024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).