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

C14H18N4O2 — CID 58063316

IUPACN-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCOc1ccn2ncc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C14H18N4O2/c1-20-12-7-8-18-13(17-12)11(9-15-18)14(19)16-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,16,19)
InChIKeyQCXSLIOXCRXUPT-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.80
Rot. Bonds3

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

N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 58063316) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID58063316
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCOc1ccn2ncc(C(=O)NC3CCCCC3)c2n1
InChIInChI=1S/C14H18N4O2/c1-20-12-7-8-18-13(17-12)11(9-15-18)14(19)16-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,16,19)
InChIKeyQCXSLIOXCRXUPT-UHFFFAOYSA-N
XLogP1.80
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 58063316) is N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide is COc1ccn2ncc(C(=O)NC3CCCCC3)c2n1.
What is the InChIKey of N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is QCXSLIOXCRXUPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-20-12-7-8-18-13(17-12)11(9-15-18)14(19)16-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,16,19).
What are the key properties of N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 58063316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).