5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

C14H20N4O — CID 82271091

IUPAC5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCC(N)c1cc(=O)n2[nH]c(C3CCCCC3)cc2n1
InChIInChI=1S/C14H20N4O/c1-9(15)11-8-14(19)18-13(16-11)7-12(17-18)10-5-3-2-4-6-10/h7-10,17H,2-6,15H2,1H3
InChIKeyCOUCMHACMUGANK-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.09
Rot. Bonds2

About 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (PubChem CID 82271091) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
PubChem CID82271091
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one
SMILESCC(N)c1cc(=O)n2[nH]c(C3CCCCC3)cc2n1
InChIInChI=1S/C14H20N4O/c1-9(15)11-8-14(19)18-13(16-11)7-12(17-18)10-5-3-2-4-6-10/h7-10,17H,2-6,15H2,1H3
InChIKeyCOUCMHACMUGANK-UHFFFAOYSA-N
XLogP2.09
TPSA76.18 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 ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The IUPAC name of 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one (CID 82271091) is 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one.
What is the SMILES notation for 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The canonical SMILES for 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is CC(N)c1cc(=O)n2[nH]c(C3CCCCC3)cc2n1.
What is the InChIKey of 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
The InChIKey is COUCMHACMUGANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9(15)11-8-14(19)18-13(16-11)7-12(17-18)10-5-3-2-4-6-10/h7-10,17H,2-6,15H2,1H3.
What are the key properties of 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one?
5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one has a molecular weight of 260.34 g/mol, XLogP of 2.09, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminoethyl)-2-cyclohexyl-1H-pyrazolo[1,5-a]pyrimidin-7-one is sourced from PubChem (CID 82271091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).