4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine

C13H18N4 — CID 114051193

IUPAC4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine
SMILESCCCn1ncc(-c2nccc(C)c2N)c1C
InChIInChI=1S/C13H18N4/c1-4-7-17-10(3)11(8-16-17)13-12(14)9(2)5-6-15-13/h5-6,8H,4,7,14H2,1-3H3
InChIKeyTVMMKFDOUYHUGM-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.55
Rot. Bonds3

About 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine

4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine (PubChem CID 114051193) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine.

Molecular Properties

Compound Name4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine
PubChem CID114051193
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine
SMILESCCCn1ncc(-c2nccc(C)c2N)c1C
InChIInChI=1S/C13H18N4/c1-4-7-17-10(3)11(8-16-17)13-12(14)9(2)5-6-15-13/h5-6,8H,4,7,14H2,1-3H3
InChIKeyTVMMKFDOUYHUGM-UHFFFAOYSA-N
XLogP2.55
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine?
The IUPAC name of 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine (CID 114051193) is 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine.
What is the SMILES notation for 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine?
The canonical SMILES for 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine is CCCn1ncc(-c2nccc(C)c2N)c1C.
What is the InChIKey of 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine?
The InChIKey is TVMMKFDOUYHUGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-4-7-17-10(3)11(8-16-17)13-12(14)9(2)5-6-15-13/h5-6,8H,4,7,14H2,1-3H3.
What are the key properties of 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine?
4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine has a molecular weight of 230.31 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(5-methyl-1-propylpyrazol-4-yl)pyridin-3-amine is sourced from PubChem (CID 114051193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).