3-(3-ethylpyrazol-1-yl)propanamide

C8H13N3O — CID 142785643

IUPAC3-(3-ethylpyrazol-1-yl)propanamide
SMILESCCc1ccn(CCC(N)=O)n1
InChIInChI=1S/C8H13N3O/c1-2-7-3-5-11(10-7)6-4-8(9)12/h3,5H,2,4,6H2,1H3,(H2,9,12)
InChIKeyGFNMUNBPIVBRIU-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.32
Rot. Bonds4

About 3-(3-ethylpyrazol-1-yl)propanamide

3-(3-ethylpyrazol-1-yl)propanamide (PubChem CID 142785643) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 3-(3-ethylpyrazol-1-yl)propanamide.

Molecular Properties

Compound Name3-(3-ethylpyrazol-1-yl)propanamide
PubChem CID142785643
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name3-(3-ethylpyrazol-1-yl)propanamide
SMILESCCc1ccn(CCC(N)=O)n1
InChIInChI=1S/C8H13N3O/c1-2-7-3-5-11(10-7)6-4-8(9)12/h3,5H,2,4,6H2,1H3,(H2,9,12)
InChIKeyGFNMUNBPIVBRIU-UHFFFAOYSA-N
XLogP0.32
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylpyrazol-1-yl)propanamide?
The IUPAC name of 3-(3-ethylpyrazol-1-yl)propanamide (CID 142785643) is 3-(3-ethylpyrazol-1-yl)propanamide.
What is the SMILES notation for 3-(3-ethylpyrazol-1-yl)propanamide?
The canonical SMILES for 3-(3-ethylpyrazol-1-yl)propanamide is CCc1ccn(CCC(N)=O)n1.
What is the InChIKey of 3-(3-ethylpyrazol-1-yl)propanamide?
The InChIKey is GFNMUNBPIVBRIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-2-7-3-5-11(10-7)6-4-8(9)12/h3,5H,2,4,6H2,1H3,(H2,9,12).
What are the key properties of 3-(3-ethylpyrazol-1-yl)propanamide?
3-(3-ethylpyrazol-1-yl)propanamide has a molecular weight of 167.21 g/mol, XLogP of 0.32, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylpyrazol-1-yl)propanamide is sourced from PubChem (CID 142785643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).