6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine

C18H20N4 — CID 57326912

IUPAC6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESNc1c(-c2ccc(C3CCCCC3)cc2)cnc2ccnn12
InChIInChI=1S/C18H20N4/c19-18-16(12-20-17-10-11-21-22(17)18)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h6-13H,1-5,19H2
InChIKeyDGDJCGDAPWYCCU-UHFFFAOYSA-N
MW292.39 g/mol
LogP4.03
Rot. Bonds2

About 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine

6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 57326912) has the molecular formula C18H20N4 and a molecular weight of 292.39 g/mol. Its IUPAC name is 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound Name6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID57326912
Molecular FormulaC18H20N4
Molecular Weight292.39 g/mol
Exact Mass292.17
IUPAC Name6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine
SMILESNc1c(-c2ccc(C3CCCCC3)cc2)cnc2ccnn12
InChIInChI=1S/C18H20N4/c19-18-16(12-20-17-10-11-21-22(17)18)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h6-13H,1-5,19H2
InChIKeyDGDJCGDAPWYCCU-UHFFFAOYSA-N
XLogP4.03
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine (CID 57326912) is 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine is Nc1c(-c2ccc(C3CCCCC3)cc2)cnc2ccnn12.
What is the InChIKey of 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is DGDJCGDAPWYCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4/c19-18-16(12-20-17-10-11-21-22(17)18)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h6-13H,1-5,19H2.
What are the key properties of 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine?
6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 292.39 g/mol, XLogP of 4.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-cyclohexylphenyl)pyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 57326912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).