N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide

C10H15N3O — CID 51114235

IUPACN-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide
SMILESCCn1cc(NC(=O)C2CCC2)cn1
InChIInChI=1S/C10H15N3O/c1-2-13-7-9(6-11-13)12-10(14)8-4-3-5-8/h6-8H,2-5H2,1H3,(H,12,14)
InChIKeyUVTFDTBDFQZRHD-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.64
Rot. Bonds3

About N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide

N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide (PubChem CID 51114235) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide
PubChem CID51114235
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide
SMILESCCn1cc(NC(=O)C2CCC2)cn1
InChIInChI=1S/C10H15N3O/c1-2-13-7-9(6-11-13)12-10(14)8-4-3-5-8/h6-8H,2-5H2,1H3,(H,12,14)
InChIKeyUVTFDTBDFQZRHD-UHFFFAOYSA-N
XLogP1.64
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide?
The IUPAC name of N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide (CID 51114235) is N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide is CCn1cc(NC(=O)C2CCC2)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide?
The InChIKey is UVTFDTBDFQZRHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-2-13-7-9(6-11-13)12-10(14)8-4-3-5-8/h6-8H,2-5H2,1H3,(H,12,14).
What are the key properties of N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide?
N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide has a molecular weight of 193.25 g/mol, XLogP of 1.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)cyclobutanecarboxamide is sourced from PubChem (CID 51114235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).