8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine

C18H24N6O — CID 42618232

IUPAC8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine
SMILESCCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12
InChIInChI=1S/C18H24N6O/c1-7-10-23(5)18-21-13(4)20-17-16(12(3)22-24(17)18)14-8-9-15(25-6)19-11(14)2/h8-9H,7,10H2,1-6H3
InChIKeyDIKAKISKKJNCKD-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.97
Rot. Bonds5

About 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine

8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine (PubChem CID 42618232) has the molecular formula C18H24N6O and a molecular weight of 340.43 g/mol. Its IUPAC name is 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine.

Molecular Properties

Compound Name8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine
PubChem CID42618232
Molecular FormulaC18H24N6O
Molecular Weight340.43 g/mol
Exact Mass340.20
IUPAC Name8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine
SMILESCCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12
InChIInChI=1S/C18H24N6O/c1-7-10-23(5)18-21-13(4)20-17-16(12(3)22-24(17)18)14-8-9-15(25-6)19-11(14)2/h8-9H,7,10H2,1-6H3
InChIKeyDIKAKISKKJNCKD-UHFFFAOYSA-N
XLogP2.97
TPSA68.44 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The IUPAC name of 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine (CID 42618232) is 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine.
What is the SMILES notation for 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The canonical SMILES for 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine is CCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12.
What is the InChIKey of 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The InChIKey is DIKAKISKKJNCKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O/c1-7-10-23(5)18-21-13(4)20-17-16(12(3)22-24(17)18)14-8-9-15(25-6)19-11(14)2/h8-9H,7,10H2,1-6H3.
What are the key properties of 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine has a molecular weight of 340.43 g/mol, XLogP of 2.97, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-methoxy-2-methyl-3-pyridinyl)-N,2,7-trimethyl-N-propylpyrazolo[1,5-a][1,3,5]triazin-4-amine is sourced from PubChem (CID 42618232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).