5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H18N6O2 — CID 175761276

IUPAC5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2ccc(N3CCN(C(=O)C4CC4)CC3)nc12
InChIInChI=1S/C15H18N6O2/c16-13(22)11-9-17-21-4-3-12(18-14(11)21)19-5-7-20(8-6-19)15(23)10-1-2-10/h3-4,9-10H,1-2,5-8H2,(H2,16,22)
InChIKeyOFFUYYKRERPZQY-UHFFFAOYSA-N
MW314.35 g/mol
LogP-0.11
Rot. Bonds3

About 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 175761276) has the molecular formula C15H18N6O2 and a molecular weight of 314.35 g/mol. Its IUPAC name is 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID175761276
Molecular FormulaC15H18N6O2
Molecular Weight314.35 g/mol
Exact Mass314.15
IUPAC Name5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESNC(=O)c1cnn2ccc(N3CCN(C(=O)C4CC4)CC3)nc12
InChIInChI=1S/C15H18N6O2/c16-13(22)11-9-17-21-4-3-12(18-14(11)21)19-5-7-20(8-6-19)15(23)10-1-2-10/h3-4,9-10H,1-2,5-8H2,(H2,16,22)
InChIKeyOFFUYYKRERPZQY-UHFFFAOYSA-N
XLogP-0.11
TPSA96.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.35
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 175761276) is 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is NC(=O)c1cnn2ccc(N3CCN(C(=O)C4CC4)CC3)nc12.
What is the InChIKey of 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is OFFUYYKRERPZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O2/c16-13(22)11-9-17-21-4-3-12(18-14(11)21)19-5-7-20(8-6-19)15(23)10-1-2-10/h3-4,9-10H,1-2,5-8H2,(H2,16,22).
What are the key properties of 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 314.35 g/mol, XLogP of -0.11, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(cyclopropanecarbonyl)piperazin-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 175761276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).