5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C14H20N4O — CID 115054548

IUPAC5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCC(C)c1c[nH]n2c(=O)cc(C3CCCNC3)nc12
InChIInChI=1S/C14H20N4O/c1-9(2)11-8-16-18-13(19)6-12(17-14(11)18)10-4-3-5-15-7-10/h6,8-10,15-16H,3-5,7H2,1-2H3
InChIKeyJYCGRZCWXFEQDS-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.61
Rot. Bonds2

About 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 115054548) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID115054548
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCC(C)c1c[nH]n2c(=O)cc(C3CCCNC3)nc12
InChIInChI=1S/C14H20N4O/c1-9(2)11-8-16-18-13(19)6-12(17-14(11)18)10-4-3-5-15-7-10/h6,8-10,15-16H,3-5,7H2,1-2H3
InChIKeyJYCGRZCWXFEQDS-UHFFFAOYSA-N
XLogP1.61
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyclobutyl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 22308884
3-propan-2-yl-5-(2-pyrrolidin-3-ylethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054563
5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115030706
5-cyclopentyl-3-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 104621505
5-cyclopentyl-3-ethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 113433939
2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054445
3-chloro-5-piperidin-4-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054586
9-methyl-2-piperidin-3-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 115054823
7-methyl-2-piperidin-3-ylpyrido[1,2-a]pyrimidin-4-one
CID 115054664
5-(azepan-4-yl)-3-chloro-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 45168309
3-cyclopropyl-5-(piperidin-3-ylmethyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054570
5-(furan-3-yl)-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 22308877

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 115054548) is 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is CC(C)c1c[nH]n2c(=O)cc(C3CCCNC3)nc12.
What is the InChIKey of 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is JYCGRZCWXFEQDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9(2)11-8-16-18-13(19)6-12(17-14(11)18)10-4-3-5-15-7-10/h6,8-10,15-16H,3-5,7H2,1-2H3.
What are the key properties of 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 260.34 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 115054548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).