5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one

C14H17N3O2 — CID 104751672

IUPAC5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
SMILESCc1cc2c(=O)n(CC(=O)C3CCCC3)ccn2n1
InChIInChI=1S/C14H17N3O2/c1-10-8-12-14(19)16(6-7-17(12)15-10)9-13(18)11-4-2-3-5-11/h6-8,11H,2-5,9H2,1H3
InChIKeyURTLPAJUXTWTAS-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.56
Rot. Bonds3

About 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one

5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one (PubChem CID 104751672) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
PubChem CID104751672
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
SMILESCc1cc2c(=O)n(CC(=O)C3CCCC3)ccn2n1
InChIInChI=1S/C14H17N3O2/c1-10-8-12-14(19)16(6-7-17(12)15-10)9-13(18)11-4-2-3-5-11/h6-8,11H,2-5,9H2,1H3
InChIKeyURTLPAJUXTWTAS-UHFFFAOYSA-N
XLogP1.56
TPSA56.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 5-(2-methyl-4-oxopyrazolo[1,5-a]pyrazin-5-yl)-4-oxopentanoate
CID 103484835
5-[3-(cyclohexylamino)propyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104735476
2-methyl-5-[2-[(propan-2-ylamino)methyl]prop-2-enyl]pyrazolo[1,5-a]pyrazin-4-one
CID 103073030
5-[2-cyclopentyl-2-(ethylamino)ethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104748238
2,2-dimethyl-3-(2-methyl-4-oxopyrazolo[1,5-a]pyrazin-5-yl)propanoic acid
CID 104734666
2-methyl-5-(pyrrolidin-3-ylmethyl)pyrazolo[1,5-a]pyrazin-4-one
CID 113446755
5-[2-(2,5-dibromothiophen-3-yl)-2-oxoethyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104735096
5-(2-aminopropyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104734809
5-(5-chloropentyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104734713
1-(2-cyclopentyl-2-oxoethyl)-4-methylpyridin-2-one
CID 104751405
5-(2-hydroxy-3,3-dimethylbutyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 104735275
5-[(4-bromophenyl)methyl]-2-methylpyrazolo[1,5-a]pyrazin-4-one
CID 113446776

Frequently Asked Questions

What is the IUPAC name of 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one (CID 104751672) is 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one is Cc1cc2c(=O)n(CC(=O)C3CCCC3)ccn2n1.
What is the InChIKey of 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is URTLPAJUXTWTAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10-8-12-14(19)16(6-7-17(12)15-10)9-13(18)11-4-2-3-5-11/h6-8,11H,2-5,9H2,1H3.
What are the key properties of 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one?
5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 259.31 g/mol, XLogP of 1.56, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-cyclopentyl-2-oxoethyl)-2-methylpyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 104751672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).