N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide

C13H16N4O — CID 1253333

IUPACN-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cnn2cccnc12
InChIInChI=1S/C13H16N4O/c18-13(16-10-5-2-1-3-6-10)11-9-15-17-8-4-7-14-12(11)17/h4,7-10H,1-3,5-6H2,(H,16,18)
InChIKeyLVODHWYJMRBZAX-UHFFFAOYSA-N
MW244.30 g/mol
LogP1.79
Rot. Bonds2

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

N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 1253333) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID1253333
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC NameN-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESO=C(NC1CCCCC1)c1cnn2cccnc12
InChIInChI=1S/C13H16N4O/c18-13(16-10-5-2-1-3-6-10)11-9-15-17-8-4-7-14-12(11)17/h4,7-10H,1-3,5-6H2,(H,16,18)
InChIKeyLVODHWYJMRBZAX-UHFFFAOYSA-N
XLogP1.79
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 1253333) is N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide is O=C(NC1CCCCC1)c1cnn2cccnc12.
What is the InChIKey of N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is LVODHWYJMRBZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c18-13(16-10-5-2-1-3-6-10)11-9-15-17-8-4-7-14-12(11)17/h4,7-10H,1-3,5-6H2,(H,16,18).
What are the key properties of N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 244.30 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylpyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 1253333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).