5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C14H20N4O — CID 82271064

IUPAC5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESNCCCc1cc(=O)n2[nH]c(C3CCCC3)cc2n1
InChIInChI=1S/C14H20N4O/c15-7-3-6-11-8-14(19)18-13(16-11)9-12(17-18)10-4-1-2-5-10/h8-10,17H,1-7,15H2
InChIKeyHNEUAJZLXSLJPD-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.57
Rot. Bonds4

About 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 82271064) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID82271064
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESNCCCc1cc(=O)n2[nH]c(C3CCCC3)cc2n1
InChIInChI=1S/C14H20N4O/c15-7-3-6-11-8-14(19)18-13(16-11)9-12(17-18)10-4-1-2-5-10/h8-10,17H,1-7,15H2
InChIKeyHNEUAJZLXSLJPD-UHFFFAOYSA-N
XLogP1.57
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-cyclohexylethyl)-2-cyclopropyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172670586
5-(3-aminopropyl)-2-pentan-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271062
5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271091
5-(3-aminopropyl)-2-tert-butyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271057
2-cyclohexyl-5-pyrrolidin-2-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 82271147
2-cyclopropyl-5-[(2,4-difluorophenyl)methyl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 172666283
2-cyclopropyl-5-piperidin-3-yl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 115054445
(6-cycloheptyl-5H-imidazo[1,2-b]pyrazol-2-yl)methanamine
CID 84795626
5-ethyl-2-[1-[3-(6-methyl-2-pyridinyl)propanoyl]piperidin-3-yl]-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 110214648
5-(2-aminoethyl)-2-cyclopropyl-1H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
CID 115031297
6-(3-aminopropyl)-4-cyclohexyl-1H-pyrimidin-2-one
CID 83850783
2-[1-[(2-amino-5-chloro-3,4-dimethylphenyl)methyl]pyrrolidin-3-yl]-5-ethyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
CID 110238026

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 82271064) is 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is NCCCc1cc(=O)n2[nH]c(C3CCCC3)cc2n1.
What is the InChIKey of 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is HNEUAJZLXSLJPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c15-7-3-6-11-8-14(19)18-13(16-11)9-12(17-18)10-4-1-2-5-10/h8-10,17H,1-7,15H2.
What are the key properties of 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 260.34 g/mol, XLogP of 1.57, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-aminopropyl)-2-cyclopentyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 82271064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).