8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine

C20H29N7 — CID 42618210

IUPAC8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine
SMILESCCN(CC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12
InChIInChI=1S/C20H29N7/c1-9-26(10-2)20-23-15(6)22-19-18(14(5)24-27(19)20)17-12(3)11-16(25(7)8)21-13(17)4/h11H,9-10H2,1-8H3
InChIKeyGEVYBKIWECOTKX-UHFFFAOYSA-N
MW367.50 g/mol
LogP3.33
Rot. Bonds5

About 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine

8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine (PubChem CID 42618210) has the molecular formula C20H29N7 and a molecular weight of 367.50 g/mol. Its IUPAC name is 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine.

Molecular Properties

Compound Name8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine
PubChem CID42618210
Molecular FormulaC20H29N7
Molecular Weight367.50 g/mol
Exact Mass367.25
IUPAC Name8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine
SMILESCCN(CC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12
InChIInChI=1S/C20H29N7/c1-9-26(10-2)20-23-15(6)22-19-18(14(5)24-27(19)20)17-12(3)11-16(25(7)8)21-13(17)4/h11H,9-10H2,1-8H3
InChIKeyGEVYBKIWECOTKX-UHFFFAOYSA-N
XLogP3.33
TPSA62.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.50
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The IUPAC name of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine (CID 42618210) is 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine.
What is the SMILES notation for 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The canonical SMILES for 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine is CCN(CC)c1nc(C)nc2c(-c3c(C)cc(N(C)C)nc3C)c(C)nn12.
What is the InChIKey of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The InChIKey is GEVYBKIWECOTKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N7/c1-9-26(10-2)20-23-15(6)22-19-18(14(5)24-27(19)20)17-12(3)11-16(25(7)8)21-13(17)4/h11H,9-10H2,1-8H3.
What are the key properties of 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine has a molecular weight of 367.50 g/mol, XLogP of 3.33, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[6-(dimethylamino)-2,4-dimethyl-3-pyridinyl]-N,N-diethyl-2,7-dimethylpyrazolo[1,5-a][1,3,5]triazin-4-amine is sourced from PubChem (CID 42618210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).