5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine

C14H14N4 — CID 722331

IUPAC5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine
SMILESCc1cc(N)n(-c2cc(C)c3ccccc3n2)n1
InChIInChI=1S/C14H14N4/c1-9-7-14(18-13(15)8-10(2)17-18)16-12-6-4-3-5-11(9)12/h3-8H,15H2,1-2H3
InChIKeyMRXLQLYHWDBUCH-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.62
Rot. Bonds1

About 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine

5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine (PubChem CID 722331) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine
PubChem CID722331
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine
SMILESCc1cc(N)n(-c2cc(C)c3ccccc3n2)n1
InChIInChI=1S/C14H14N4/c1-9-7-14(18-13(15)8-10(2)17-18)16-12-6-4-3-5-11(9)12/h3-8H,15H2,1-2H3
InChIKeyMRXLQLYHWDBUCH-UHFFFAOYSA-N
XLogP2.62
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine?
The IUPAC name of 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine (CID 722331) is 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine.
What is the SMILES notation for 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine?
The canonical SMILES for 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine is Cc1cc(N)n(-c2cc(C)c3ccccc3n2)n1.
What is the InChIKey of 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine?
The InChIKey is MRXLQLYHWDBUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-9-7-14(18-13(15)8-10(2)17-18)16-12-6-4-3-5-11(9)12/h3-8H,15H2,1-2H3.
What are the key properties of 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine?
5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine has a molecular weight of 238.29 g/mol, XLogP of 2.62, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(4-methylquinolin-2-yl)pyrazol-3-amine is sourced from PubChem (CID 722331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).