3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine

C10H11ClN4 — CID 114663348

IUPAC3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(-c2c(Cl)cnn2C)c1
InChIInChI=1S/C10H11ClN4/c1-6-3-7(10(12)13-4-6)9-8(11)5-14-15(9)2/h3-5H,1-2H3,(H2,12,13)
InChIKeyDAODCYXZLJRQMW-UHFFFAOYSA-N
MW222.68 g/mol
LogP2.03
Rot. Bonds1

About 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine

3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine (PubChem CID 114663348) has the molecular formula C10H11ClN4 and a molecular weight of 222.68 g/mol. Its IUPAC name is 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine
PubChem CID114663348
Molecular FormulaC10H11ClN4
Molecular Weight222.68 g/mol
Exact Mass222.07
IUPAC Name3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine
SMILESCc1cnc(N)c(-c2c(Cl)cnn2C)c1
InChIInChI=1S/C10H11ClN4/c1-6-3-7(10(12)13-4-6)9-8(11)5-14-15(9)2/h3-5H,1-2H3,(H2,12,13)
InChIKeyDAODCYXZLJRQMW-UHFFFAOYSA-N
XLogP2.03
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.68
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine?
The IUPAC name of 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine (CID 114663348) is 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine.
What is the SMILES notation for 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine?
The canonical SMILES for 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine is Cc1cnc(N)c(-c2c(Cl)cnn2C)c1.
What is the InChIKey of 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine?
The InChIKey is DAODCYXZLJRQMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4/c1-6-3-7(10(12)13-4-6)9-8(11)5-14-15(9)2/h3-5H,1-2H3,(H2,12,13).
What are the key properties of 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine?
3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine has a molecular weight of 222.68 g/mol, XLogP of 2.03, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-chloro-1-methylpyrazol-5-yl)-5-methylpyridin-2-amine is sourced from PubChem (CID 114663348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).