N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H23N5O — CID 19440824

IUPACN-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1cnn2c(C)cc(C)nc12
InChIInChI=1S/C15H23N5O/c1-5-19(6-2)8-7-16-15(21)13-10-17-20-12(4)9-11(3)18-14(13)20/h9-10H,5-8H2,1-4H3,(H,16,21)
InChIKeyFFQCAFKLNMIWBP-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.42
Rot. Bonds6

About N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 19440824) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID19440824
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC NameN-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1cnn2c(C)cc(C)nc12
InChIInChI=1S/C15H23N5O/c1-5-19(6-2)8-7-16-15(21)13-10-17-20-12(4)9-11(3)18-14(13)20/h9-10H,5-8H2,1-4H3,(H,16,21)
InChIKeyFFQCAFKLNMIWBP-UHFFFAOYSA-N
XLogP1.42
TPSA62.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 19440824) is N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is CCN(CC)CCNC(=O)c1cnn2c(C)cc(C)nc12.
What is the InChIKey of N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is FFQCAFKLNMIWBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-5-19(6-2)8-7-16-15(21)13-10-17-20-12(4)9-11(3)18-14(13)20/h9-10H,5-8H2,1-4H3,(H,16,21).
What are the key properties of N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 289.38 g/mol, XLogP of 1.42, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 19440824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).