2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide

C14H19N5O2 — CID 134796284

IUPAC2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide
SMILESCOCC(=O)NC1CCCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C14H19N5O2/c1-21-10-13(20)17-11-3-2-8-18(9-11)14-5-6-15-12-4-7-16-19(12)14/h4-7,11H,2-3,8-10H2,1H3,(H,17,20)
InChIKeyIKJNMWDOLWCPIX-UHFFFAOYSA-N
MW289.34 g/mol
LogP0.46
Rot. Bonds4

About 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide

2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide (PubChem CID 134796284) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide
PubChem CID134796284
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide
SMILESCOCC(=O)NC1CCCN(c2ccnc3ccnn23)C1
InChIInChI=1S/C14H19N5O2/c1-21-10-13(20)17-11-3-2-8-18(9-11)14-5-6-15-12-4-7-16-19(12)14/h4-7,11H,2-3,8-10H2,1H3,(H,17,20)
InChIKeyIKJNMWDOLWCPIX-UHFFFAOYSA-N
XLogP0.46
TPSA71.76 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide?
The IUPAC name of 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide (CID 134796284) is 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide.
What is the SMILES notation for 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide?
The canonical SMILES for 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide is COCC(=O)NC1CCCN(c2ccnc3ccnn23)C1.
What is the InChIKey of 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide?
The InChIKey is IKJNMWDOLWCPIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-21-10-13(20)17-11-3-2-8-18(9-11)14-5-6-15-12-4-7-16-19(12)14/h4-7,11H,2-3,8-10H2,1H3,(H,17,20).
What are the key properties of 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide?
2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide has a molecular weight of 289.34 g/mol, XLogP of 0.46, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-pyrazolo[1,5-a]pyrimidin-7-ylpiperidin-3-yl)acetamide is sourced from PubChem (CID 134796284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).