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

C14H18N4O — CID 115054445

IUPAC2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESO=c1cc(C2CCCNC2)nc2cc(C3CC3)[nH]n12
InChIInChI=1S/C14H18N4O/c19-14-7-11(10-2-1-5-15-8-10)16-13-6-12(9-3-4-9)17-18(13)14/h6-7,9-10,15,17H,1-5,8H2
InChIKeyUQXHGHKFAFYPBC-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.37
Rot. Bonds2

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

2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 115054445) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID115054445
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESO=c1cc(C2CCCNC2)nc2cc(C3CC3)[nH]n12
InChIInChI=1S/C14H18N4O/c19-14-7-11(10-2-1-5-15-8-10)16-13-6-12(9-3-4-9)17-18(13)14/h6-7,9-10,15,17H,1-5,8H2
InChIKeyUQXHGHKFAFYPBC-UHFFFAOYSA-N
XLogP1.37
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclohexyl-5-pyrrolidin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271147
5,6-dimethyl-2-[(3R)-piperidin-3-yl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 98078017
5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115030706
5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271091
5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271064
5-(2-cyclohexylethyl)-2-cyclopropyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172670586
7-methyl-2-piperidin-3-ylpyrido[1,2-a]pyrimidin-4-one
CID 115054664
5-piperidin-3-yl-3-propan-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054548
9-methyl-2-piperidin-3-yl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 115054823
2-methyl-5-piperidin-3-yl-1H-pyrazol-3-one;dihydrochloride
CID 71298839
2-(4-fluorophenyl)-5-piperidin-3-ylpyrazolo[1,5-a]pyrimidin-7-amine
CID 110214014
5-(azepan-4-yl)-3-chloro-2-methyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 45168309

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 115054445) is 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is O=c1cc(C2CCCNC2)nc2cc(C3CC3)[nH]n12.
What is the InChIKey of 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is UQXHGHKFAFYPBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c19-14-7-11(10-2-1-5-15-8-10)16-13-6-12(9-3-4-9)17-18(13)14/h6-7,9-10,15,17H,1-5,8H2.
What are the key properties of 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 258.32 g/mol, XLogP of 1.37, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 115054445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).