1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine

C16H16N4 — CID 80521659

IUPAC1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine
SMILESCc1ccccc1-c1nn(C)c(N)c1-c1ccccn1
InChIInChI=1S/C16H16N4/c1-11-7-3-4-8-12(11)15-14(16(17)20(2)19-15)13-9-5-6-10-18-13/h3-10H,17H2,1-2H3
InChIKeyOZOZUSGYIWIOMB-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.04
Rot. Bonds2

About 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine

1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine (PubChem CID 80521659) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine
PubChem CID80521659
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine
SMILESCc1ccccc1-c1nn(C)c(N)c1-c1ccccn1
InChIInChI=1S/C16H16N4/c1-11-7-3-4-8-12(11)15-14(16(17)20(2)19-15)13-9-5-6-10-18-13/h3-10H,17H2,1-2H3
InChIKeyOZOZUSGYIWIOMB-UHFFFAOYSA-N
XLogP3.04
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-chloro-2-methylphenyl)-1-methyl-4-pyridin-2-ylpyrazol-5-amine
CID 82871264
1-methyl-3-(4-methylthiophen-3-yl)-4-pyridin-2-ylpyrazol-5-amine
CID 80521660
3-(3,4-dimethylphenyl)-1-methyl-4-pyridin-2-ylpyrazol-5-amine
CID 80522035
3-(4,5-dimethylthiophen-2-yl)-1-methyl-4-pyridin-2-ylpyrazol-5-amine
CID 80521046
3-(3-bromo-4-methylphenyl)-1-methyl-4-pyridin-2-ylpyrazol-5-amine
CID 81460629
4-(3,4-dimethylphenyl)-1-methyl-3-pyridin-2-ylpyrazol-5-amine
CID 62901484
1-methyl-4-pyridin-2-yl-3-pyridin-3-ylpyrazol-5-amine
CID 80521128
2-(2-methylphenyl)pyridine
CID 144596153
3-(2,3-dimethylphenyl)-1-methyl-4-phenylpyrazol-5-amine
CID 43336371
3-(5-ethylthiophen-2-yl)-1-methyl-4-pyridin-2-ylpyrazol-5-amine
CID 80521721
1-methyl-4-(2-methylphenyl)-3-pyrimidin-5-ylpyrazol-5-amine
CID 102921938
1-methyl-4-(2-methylphenyl)-3-(5-methylthiophen-2-yl)pyrazol-5-amine
CID 43158510

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine?
The IUPAC name of 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine (CID 80521659) is 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine.
What is the SMILES notation for 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine?
The canonical SMILES for 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine is Cc1ccccc1-c1nn(C)c(N)c1-c1ccccn1.
What is the InChIKey of 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine?
The InChIKey is OZOZUSGYIWIOMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-11-7-3-4-8-12(11)15-14(16(17)20(2)19-15)13-9-5-6-10-18-13/h3-10H,17H2,1-2H3.
What are the key properties of 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine?
1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine has a molecular weight of 264.33 g/mol, XLogP of 3.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-methylphenyl)-4-pyridin-2-ylpyrazol-5-amine is sourced from PubChem (CID 80521659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).