N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide

C14H20N4O2 — CID 53003857

IUPACN-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide
SMILESCc1cc2n(n1)CCC(=O)N2CC(=O)NC1CCCC1
InChIInChI=1S/C14H20N4O2/c1-10-8-13-17(14(20)6-7-18(13)16-10)9-12(19)15-11-4-2-3-5-11/h8,11H,2-7,9H2,1H3,(H,15,19)
InChIKeyBVHQIXUDMWCEAB-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.99
Rot. Bonds3

About N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide

N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide (PubChem CID 53003857) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide
PubChem CID53003857
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC NameN-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide
SMILESCc1cc2n(n1)CCC(=O)N2CC(=O)NC1CCCC1
InChIInChI=1S/C14H20N4O2/c1-10-8-13-17(14(20)6-7-18(13)16-10)9-12(19)15-11-4-2-3-5-11/h8,11H,2-7,9H2,1H3,(H,15,19)
InChIKeyBVHQIXUDMWCEAB-UHFFFAOYSA-N
XLogP0.99
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide (CID 53003857) is N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide is Cc1cc2n(n1)CCC(=O)N2CC(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide?
The InChIKey is BVHQIXUDMWCEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-10-8-13-17(14(20)6-7-18(13)16-10)9-12(19)15-11-4-2-3-5-11/h8,11H,2-7,9H2,1H3,(H,15,19).
What are the key properties of N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide?
N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide has a molecular weight of 276.34 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl)acetamide is sourced from PubChem (CID 53003857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).