5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine

C10H11ClN4O — CID 69133234

IUPAC5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine
SMILESCOc1ncc(N)cc1-c1c(Cl)cnn1C
InChIInChI=1S/C10H11ClN4O/c1-15-9(8(11)5-14-15)7-3-6(12)4-13-10(7)16-2/h3-5H,12H2,1-2H3
InChIKeyJWHBIKLXJHFZNY-UHFFFAOYSA-N
MW238.68 g/mol
LogP1.73
Rot. Bonds2

About 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine

5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine (PubChem CID 69133234) has the molecular formula C10H11ClN4O and a molecular weight of 238.68 g/mol. Its IUPAC name is 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine.

Molecular Properties

Compound Name5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine
PubChem CID69133234
Molecular FormulaC10H11ClN4O
Molecular Weight238.68 g/mol
Exact Mass238.06
IUPAC Name5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine
SMILESCOc1ncc(N)cc1-c1c(Cl)cnn1C
InChIInChI=1S/C10H11ClN4O/c1-15-9(8(11)5-14-15)7-3-6(12)4-13-10(7)16-2/h3-5H,12H2,1-2H3
InChIKeyJWHBIKLXJHFZNY-UHFFFAOYSA-N
XLogP1.73
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.68
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine?
The IUPAC name of 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine (CID 69133234) is 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine.
What is the SMILES notation for 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine?
The canonical SMILES for 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine is COc1ncc(N)cc1-c1c(Cl)cnn1C.
What is the InChIKey of 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine?
The InChIKey is JWHBIKLXJHFZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O/c1-15-9(8(11)5-14-15)7-3-6(12)4-13-10(7)16-2/h3-5H,12H2,1-2H3.
What are the key properties of 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine?
5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine has a molecular weight of 238.68 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chloro-1-methylpyrazol-5-yl)-6-methoxypyridin-3-amine is sourced from PubChem (CID 69133234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).