N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide

C13H20N4O — CID 104619153

IUPACN-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide
SMILESCCc1cn[nH]c1NC(=O)C1CC12CCNCC2
InChIInChI=1S/C13H20N4O/c1-2-9-8-15-17-11(9)16-12(18)10-7-13(10)3-5-14-6-4-13/h8,10,14H,2-7H2,1H3,(H2,15,16,17,18)
InChIKeyYEDIUGOAEKBJHN-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.30
Rot. Bonds3

About N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide

N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide (PubChem CID 104619153) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide.

Molecular Properties

Compound NameN-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide
PubChem CID104619153
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC NameN-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide
SMILESCCc1cn[nH]c1NC(=O)C1CC12CCNCC2
InChIInChI=1S/C13H20N4O/c1-2-9-8-15-17-11(9)16-12(18)10-7-13(10)3-5-14-6-4-13/h8,10,14H,2-7H2,1H3,(H2,15,16,17,18)
InChIKeyYEDIUGOAEKBJHN-UHFFFAOYSA-N
XLogP1.30
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethyl-1H-pyrazol-5-yl)pyrrolidine-3-carboxamide
CID 104619200
(2R)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-6-azaspiro[2.5]octane-2-carboxamide
CID 129414179
N-(4-ethyl-1H-pyrazol-5-yl)oxane-4-carboxamide
CID 115680700
N-(4-ethyl-1H-pyrazol-5-yl)pyrrolidine-2-carboxamide
CID 104619250
N-[(4-ethylphenyl)methyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 103872581
(2R)-N-(4-ethyl-1H-pyrazol-5-yl)oxolane-2-carboxamide
CID 103852363
N-(4-hydroxy-2,5-dimethylphenyl)-6-azaspiro[2.5]octane-2-carboxamide
CID 106954509
2-[(4-ethyl-1H-pyrazol-5-yl)carbamoyl]cyclopentane-1-carboxylic acid
CID 104617433
N-(4-ethyl-1H-pyrazol-5-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114628039
N-(4-ethyl-1H-pyrazol-5-yl)-1-methylcyclohexane-1-carboxamide
CID 106827945
N-(4-ethyl-1H-pyrazol-5-yl)thiolane-2-carboxamide
CID 115692476
2-(1-adamantyl)-N-(4-ethyl-1H-pyrazol-5-yl)acetamide
CID 115692303

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide?
The IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide (CID 104619153) is N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide.
What is the SMILES notation for N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide?
The canonical SMILES for N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide is CCc1cn[nH]c1NC(=O)C1CC12CCNCC2.
What is the InChIKey of N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide?
The InChIKey is YEDIUGOAEKBJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-2-9-8-15-17-11(9)16-12(18)10-7-13(10)3-5-14-6-4-13/h8,10,14H,2-7H2,1H3,(H2,15,16,17,18).
What are the key properties of N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide?
N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.30, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1H-pyrazol-5-yl)-6-azaspiro[2.5]octane-2-carboxamide is sourced from PubChem (CID 104619153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).