N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C15H20N4O — CID 1097821

IUPACN-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C15H20N4O/c1-10-8-11(2)19-14(17-10)13(9-16-19)15(20)18-12-6-4-3-5-7-12/h8-9,12H,3-7H2,1-2H3,(H,18,20)
InChIKeyVETSUNZWTJUJCA-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.41
Rot. Bonds2

About N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 1097821) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID1097821
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC NameN-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C15H20N4O/c1-10-8-11(2)19-14(17-10)13(9-16-19)15(20)18-12-6-4-3-5-7-12/h8-9,12H,3-7H2,1-2H3,(H,18,20)
InChIKeyVETSUNZWTJUJCA-UHFFFAOYSA-N
XLogP2.41
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 1097821) is N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cc(C)n2ncc(C(=O)NC3CCCCC3)c2n1.
What is the InChIKey of N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is VETSUNZWTJUJCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-10-8-11(2)19-14(17-10)13(9-16-19)15(20)18-12-6-4-3-5-7-12/h8-9,12H,3-7H2,1-2H3,(H,18,20).
What are the key properties of N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 1097821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).