5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine

C10H12ClN5 — CID 141267684

IUPAC5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine
SMILESCc1cc(Nc2cc(N)c(Cl)cn2)n(C)n1
InChIInChI=1S/C10H12ClN5/c1-6-3-10(16(2)15-6)14-9-4-8(12)7(11)5-13-9/h3-5H,1-2H3,(H3,12,13,14)
InChIKeyTVNUWQOKTVAERB-UHFFFAOYSA-N
MW237.69 g/mol
LogP2.10
Rot. Bonds2

About 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine

5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine (PubChem CID 141267684) has the molecular formula C10H12ClN5 and a molecular weight of 237.69 g/mol. Its IUPAC name is 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine.

Molecular Properties

Compound Name5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine
PubChem CID141267684
Molecular FormulaC10H12ClN5
Molecular Weight237.69 g/mol
Exact Mass237.08
IUPAC Name5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine
SMILESCc1cc(Nc2cc(N)c(Cl)cn2)n(C)n1
InChIInChI=1S/C10H12ClN5/c1-6-3-10(16(2)15-6)14-9-4-8(12)7(11)5-13-9/h3-5H,1-2H3,(H3,12,13,14)
InChIKeyTVNUWQOKTVAERB-UHFFFAOYSA-N
XLogP2.10
TPSA68.76 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine?
The IUPAC name of 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine (CID 141267684) is 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine.
What is the SMILES notation for 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine?
The canonical SMILES for 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine is Cc1cc(Nc2cc(N)c(Cl)cn2)n(C)n1.
What is the InChIKey of 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine?
The InChIKey is TVNUWQOKTVAERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN5/c1-6-3-10(16(2)15-6)14-9-4-8(12)7(11)5-13-9/h3-5H,1-2H3,(H3,12,13,14).
What are the key properties of 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine?
5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine has a molecular weight of 237.69 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-N-(2,5-dimethylpyrazol-3-yl)pyridine-2,4-diamine is sourced from PubChem (CID 141267684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).