2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide

C19H23N7O — CID 167935038

IUPAC2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1cc2ncc(C(=O)NCc3ccnc(N4CCNCC4)c3)c(C)n2n1
InChIInChI=1S/C19H23N7O/c1-13-9-18-22-12-16(14(2)26(18)24-13)19(27)23-11-15-3-4-21-17(10-15)25-7-5-20-6-8-25/h3-4,9-10,12,20H,5-8,11H2,1-2H3,(H,23,27)
InChIKeyUYZMUZVWJWQPDO-UHFFFAOYSA-N
MW365.44 g/mol
LogP1.08
Rot. Bonds4

About 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide

2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 167935038) has the molecular formula C19H23N7O and a molecular weight of 365.44 g/mol. Its IUPAC name is 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID167935038
Molecular FormulaC19H23N7O
Molecular Weight365.44 g/mol
Exact Mass365.20
IUPAC Name2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCc1cc2ncc(C(=O)NCc3ccnc(N4CCNCC4)c3)c(C)n2n1
InChIInChI=1S/C19H23N7O/c1-13-9-18-22-12-16(14(2)26(18)24-13)19(27)23-11-15-3-4-21-17(10-15)25-7-5-20-6-8-25/h3-4,9-10,12,20H,5-8,11H2,1-2H3,(H,23,27)
InChIKeyUYZMUZVWJWQPDO-UHFFFAOYSA-N
XLogP1.08
TPSA87.45 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.44
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide with MolForge

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Related Compounds

2,7-dimethyl-N-[(3,4,5-trimethoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 24641486
2,7-dimethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 61003398
2,7-dimethyl-N-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 38797108
2,7-dimethyl-N-[2-(2-methylpropanoylamino)ethyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 24666481
5-methyl-1-piperidin-4-yl-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]triazole-4-carboxamide
CID 119841519
2,7-dimethyl-N-[(2,4,5-trimethoxyphenyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide
CID 24641471
N-[[2-(azepan-1-yl)-4-pyridinyl]methyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 154737151
5-methyl-1-piperidin-4-yl-N-[(2-piperidin-1-yl-4-pyridinyl)methyl]triazole-4-carboxamide
CID 119841338
2-(4-hydroxypiperidin-1-yl)-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]acetamide
CID 167927821
2-methyl-N-[(2-pyrrolidin-1-yl-4-pyridinyl)methyl]quinoline-4-carboxamide
CID 36754760
2,5-dimethyl-N-[(2-morpholin-4-yl-4-pyridinyl)methyl]benzamide
CID 32585579
4-fluoro-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]-1H-benzimidazole-5-carboxamide;2,2,2-trifluoroacetic acid
CID 167948261

Frequently Asked Questions

What is the IUPAC name of 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide (CID 167935038) is 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide is Cc1cc2ncc(C(=O)NCc3ccnc(N4CCNCC4)c3)c(C)n2n1.
What is the InChIKey of 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is UYZMUZVWJWQPDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7O/c1-13-9-18-22-12-16(14(2)26(18)24-13)19(27)23-11-15-3-4-21-17(10-15)25-7-5-20-6-8-25/h3-4,9-10,12,20H,5-8,11H2,1-2H3,(H,23,27).
What are the key properties of 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide?
2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 365.44 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-N-[(2-piperazin-1-yl-4-pyridinyl)methyl]pyrazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 167935038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).