2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide

C14H20N4O — CID 141189662

IUPAC2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)Cc1cnn2c(C)cc(C)nc12
InChIInChI=1S/C14H20N4O/c1-5-17(6-2)13(19)8-12-9-15-18-11(4)7-10(3)16-14(12)18/h7,9H,5-6,8H2,1-4H3
InChIKeyJOWTXKTWRJEDLO-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.76
Rot. Bonds4

About 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide

2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide (PubChem CID 141189662) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide.

Molecular Properties

Compound Name2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide
PubChem CID141189662
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)Cc1cnn2c(C)cc(C)nc12
InChIInChI=1S/C14H20N4O/c1-5-17(6-2)13(19)8-12-9-15-18-11(4)7-10(3)16-14(12)18/h7,9H,5-6,8H2,1-4H3
InChIKeyJOWTXKTWRJEDLO-UHFFFAOYSA-N
XLogP1.76
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methylamino]-2-oxoacetate
CID 110481840
3-[(5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carbonyl)-ethylamino]propanoic acid
CID 61007292
2-[5,7-dimethyl-2-(4-propan-2-ylphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]-N,N-diethylacetamide
CID 177056290
N-[(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methyl]cyclopropanecarboxamide
CID 110478133
N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19440824
N-[(2R)-butan-2-yl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1097804
3,5,7-trimethylpyrazolo[1,5-a]pyrimidine
CID 18684975
2-[5,7-dimethyl-2-[4-(methylsulfanylmethoxy)phenyl]pyrazolo[1,5-a]pyrimidin-3-yl]-N,N-diethylacetamide
CID 71181881
N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 19440629
3-ethyl-7-methylpyrazolo[1,5-a]pyrimidin-5-amine
CID 145164018
N-(2-aminoethyl)-N,5,7-trimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 55103751
1-[(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)methyl]-4-methyl-1,4-diazepane-6-carboxamide
CID 127247823

Frequently Asked Questions

What is the IUPAC name of 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide?
The IUPAC name of 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide (CID 141189662) is 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide.
What is the SMILES notation for 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide?
The canonical SMILES for 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide is CCN(CC)C(=O)Cc1cnn2c(C)cc(C)nc12.
What is the InChIKey of 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide?
The InChIKey is JOWTXKTWRJEDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-5-17(6-2)13(19)8-12-9-15-18-11(4)7-10(3)16-14(12)18/h7,9H,5-6,8H2,1-4H3.
What are the key properties of 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide?
2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide has a molecular weight of 260.34 g/mol, XLogP of 1.76, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,7-dimethylpyrazolo[1,5-a]pyrimidin-3-yl)-N,N-diethylacetamide is sourced from PubChem (CID 141189662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).