5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

C17H22N6O4 — CID 137018339

IUPAC5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NCCN1CCOC1=O)c1cnn2c(C3CCNCC3)cc(=O)[nH]c12
InChIInChI=1S/C17H22N6O4/c24-14-9-13(11-1-3-18-4-2-11)23-15(21-14)12(10-20-23)16(25)19-5-6-22-7-8-27-17(22)26/h9-11,18H,1-8H2,(H,19,25)(H,21,24)
InChIKeyCOEWPPLLSZGLIH-UHFFFAOYSA-N
MW374.40 g/mol
LogP-0.33
Rot. Bonds5

About 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 137018339) has the molecular formula C17H22N6O4 and a molecular weight of 374.40 g/mol. Its IUPAC name is 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID137018339
Molecular FormulaC17H22N6O4
Molecular Weight374.40 g/mol
Exact Mass374.17
IUPAC Name5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NCCN1CCOC1=O)c1cnn2c(C3CCNCC3)cc(=O)[nH]c12
InChIInChI=1S/C17H22N6O4/c24-14-9-13(11-1-3-18-4-2-11)23-15(21-14)12(10-20-23)16(25)19-5-6-22-7-8-27-17(22)26/h9-11,18H,1-8H2,(H,19,25)(H,21,24)
InChIKeyCOEWPPLLSZGLIH-UHFFFAOYSA-N
XLogP-0.33
TPSA120.83 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 137018339) is 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(NCCN1CCOC1=O)c1cnn2c(C3CCNCC3)cc(=O)[nH]c12.
What is the InChIKey of 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is COEWPPLLSZGLIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6O4/c24-14-9-13(11-1-3-18-4-2-11)23-15(21-14)12(10-20-23)16(25)19-5-6-22-7-8-27-17(22)26/h9-11,18H,1-8H2,(H,19,25)(H,21,24).
What are the key properties of 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide?
5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 374.40 g/mol, XLogP of -0.33, 5 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-N-[2-(2-oxo-1,3-oxazolidin-3-yl)ethyl]-7-piperidin-4-yl-4H-pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 137018339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).