4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide

C9H15N3O2 — CID 104621851

IUPAC4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
SMILESCc1cn[nH]c1NC(=O)CCC(C)O
InChIInChI=1S/C9H15N3O2/c1-6-5-10-12-9(6)11-8(14)4-3-7(2)13/h5,7,13H,3-4H2,1-2H3,(H2,10,11,12,14)
InChIKeyROSLLSGVXXQTON-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.82
Rot. Bonds4

About 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide

4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide (PubChem CID 104621851) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
PubChem CID104621851
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide
SMILESCc1cn[nH]c1NC(=O)CCC(C)O
InChIInChI=1S/C9H15N3O2/c1-6-5-10-12-9(6)11-8(14)4-3-7(2)13/h5,7,13H,3-4H2,1-2H3,(H2,10,11,12,14)
InChIKeyROSLLSGVXXQTON-UHFFFAOYSA-N
XLogP0.82
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide?
The IUPAC name of 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide (CID 104621851) is 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide is Cc1cn[nH]c1NC(=O)CCC(C)O.
What is the InChIKey of 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide?
The InChIKey is ROSLLSGVXXQTON-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-6-5-10-12-9(6)11-8(14)4-3-7(2)13/h5,7,13H,3-4H2,1-2H3,(H2,10,11,12,14).
What are the key properties of 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide?
4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide has a molecular weight of 197.24 g/mol, XLogP of 0.82, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(4-methyl-1H-pyrazol-5-yl)pentanamide is sourced from PubChem (CID 104621851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).