2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide

C10H17N3O2 — CID 123424591

IUPAC2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide
SMILESCCCCC(O)C(=O)Nc1ccn(C)n1
InChIInChI=1S/C10H17N3O2/c1-3-4-5-8(14)10(15)11-9-6-7-13(2)12-9/h6-8,14H,3-5H2,1-2H3,(H,11,12,15)
InChIKeyIEEIKMOKMHEIES-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.91
Rot. Bonds5

About 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide

2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide (PubChem CID 123424591) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide.

Molecular Properties

Compound Name2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide
PubChem CID123424591
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide
SMILESCCCCC(O)C(=O)Nc1ccn(C)n1
InChIInChI=1S/C10H17N3O2/c1-3-4-5-8(14)10(15)11-9-6-7-13(2)12-9/h6-8,14H,3-5H2,1-2H3,(H,11,12,15)
InChIKeyIEEIKMOKMHEIES-UHFFFAOYSA-N
XLogP0.91
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide?
The IUPAC name of 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide (CID 123424591) is 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide.
What is the SMILES notation for 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide?
The canonical SMILES for 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide is CCCCC(O)C(=O)Nc1ccn(C)n1.
What is the InChIKey of 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide?
The InChIKey is IEEIKMOKMHEIES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-3-4-5-8(14)10(15)11-9-6-7-13(2)12-9/h6-8,14H,3-5H2,1-2H3,(H,11,12,15).
What are the key properties of 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide?
2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide has a molecular weight of 211.26 g/mol, XLogP of 0.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(1-methylpyrazol-3-yl)hexanamide is sourced from PubChem (CID 123424591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).