4-hydroxy-3-pyrazol-1-ylpentanamide

C8H13N3O2 — CID 56974979

IUPAC4-hydroxy-3-pyrazol-1-ylpentanamide
SMILESCC(O)C(CC(N)=O)n1cccn1
InChIInChI=1S/C8H13N3O2/c1-6(12)7(5-8(9)13)11-4-2-3-10-11/h2-4,6-7,12H,5H2,1H3,(H2,9,13)
InChIKeyBFACVDDZQDNFIF-UHFFFAOYSA-N
MW183.21 g/mol
LogP-0.32
Rot. Bonds4

About 4-hydroxy-3-pyrazol-1-ylpentanamide

4-hydroxy-3-pyrazol-1-ylpentanamide (PubChem CID 56974979) has the molecular formula C8H13N3O2 and a molecular weight of 183.21 g/mol. Its IUPAC name is 4-hydroxy-3-pyrazol-1-ylpentanamide.

Molecular Properties

Compound Name4-hydroxy-3-pyrazol-1-ylpentanamide
PubChem CID56974979
Molecular FormulaC8H13N3O2
Molecular Weight183.21 g/mol
Exact Mass183.10
IUPAC Name4-hydroxy-3-pyrazol-1-ylpentanamide
SMILESCC(O)C(CC(N)=O)n1cccn1
InChIInChI=1S/C8H13N3O2/c1-6(12)7(5-8(9)13)11-4-2-3-10-11/h2-4,6-7,12H,5H2,1H3,(H2,9,13)
InChIKeyBFACVDDZQDNFIF-UHFFFAOYSA-N
XLogP-0.32
TPSA81.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-pyrazol-1-ylpentanamide?
The IUPAC name of 4-hydroxy-3-pyrazol-1-ylpentanamide (CID 56974979) is 4-hydroxy-3-pyrazol-1-ylpentanamide.
What is the SMILES notation for 4-hydroxy-3-pyrazol-1-ylpentanamide?
The canonical SMILES for 4-hydroxy-3-pyrazol-1-ylpentanamide is CC(O)C(CC(N)=O)n1cccn1.
What is the InChIKey of 4-hydroxy-3-pyrazol-1-ylpentanamide?
The InChIKey is BFACVDDZQDNFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O2/c1-6(12)7(5-8(9)13)11-4-2-3-10-11/h2-4,6-7,12H,5H2,1H3,(H2,9,13).
What are the key properties of 4-hydroxy-3-pyrazol-1-ylpentanamide?
4-hydroxy-3-pyrazol-1-ylpentanamide has a molecular weight of 183.21 g/mol, XLogP of -0.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-pyrazol-1-ylpentanamide is sourced from PubChem (CID 56974979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).