N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide

C17H20N6O — CID 56738642

IUPACN-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCc1cc2nc(C(=O)NCc3cccnc3N(C)C)cc(C)n2n1
InChIInChI=1S/C17H20N6O/c1-11-8-15-20-14(9-12(2)23(15)21-11)17(24)19-10-13-6-5-7-18-16(13)22(3)4/h5-9H,10H2,1-4H3,(H,19,24)
InChIKeyZBWOXKXNBAMBLI-UHFFFAOYSA-N
MW324.39 g/mol
LogP1.74
Rot. Bonds4

About N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide

N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide (PubChem CID 56738642) has the molecular formula C17H20N6O and a molecular weight of 324.39 g/mol. Its IUPAC name is N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
PubChem CID56738642
Molecular FormulaC17H20N6O
Molecular Weight324.39 g/mol
Exact Mass324.17
IUPAC NameN-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide
SMILESCc1cc2nc(C(=O)NCc3cccnc3N(C)C)cc(C)n2n1
InChIInChI=1S/C17H20N6O/c1-11-8-15-20-14(9-12(2)23(15)21-11)17(24)19-10-13-6-5-7-18-16(13)22(3)4/h5-9H,10H2,1-4H3,(H,19,24)
InChIKeyZBWOXKXNBAMBLI-UHFFFAOYSA-N
XLogP1.74
TPSA75.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The IUPAC name of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide (CID 56738642) is N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide.
What is the SMILES notation for N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The canonical SMILES for N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide is Cc1cc2nc(C(=O)NCc3cccnc3N(C)C)cc(C)n2n1.
What is the InChIKey of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
The InChIKey is ZBWOXKXNBAMBLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O/c1-11-8-15-20-14(9-12(2)23(15)21-11)17(24)19-10-13-6-5-7-18-16(13)22(3)4/h5-9H,10H2,1-4H3,(H,19,24).
What are the key properties of N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide?
N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide has a molecular weight of 324.39 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(dimethylamino)-3-pyridinyl]methyl]-2,7-dimethylpyrazolo[1,5-a]pyrimidine-5-carboxamide is sourced from PubChem (CID 56738642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).