5-hydroxypentanoic acid;pyridine

C10H15NO3 — CID 23505435

IUPAC5-hydroxypentanoic acid;pyridine
SMILESO=C(O)CCCCO.c1ccncc1
InChIInChI=1S/C5H5N.C5H10O3/c1-2-4-6-5-3-1;6-4-2-1-3-5(7)8/h1-5H;6H,1-4H2,(H,7,8)
InChIKeyXZTOLAWQIHJLRW-UHFFFAOYSA-N
MW197.23 g/mol
LogP1.32
Rot. Bonds4

About 5-hydroxypentanoic acid;pyridine

5-hydroxypentanoic acid;pyridine (PubChem CID 23505435) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is 5-hydroxypentanoic acid;pyridine.

Molecular Properties

Compound Name5-hydroxypentanoic acid;pyridine
PubChem CID23505435
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name5-hydroxypentanoic acid;pyridine
SMILESO=C(O)CCCCO.c1ccncc1
InChIInChI=1S/C5H5N.C5H10O3/c1-2-4-6-5-3-1;6-4-2-1-3-5(7)8/h1-5H;6H,1-4H2,(H,7,8)
InChIKeyXZTOLAWQIHJLRW-UHFFFAOYSA-N
XLogP1.32
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

butanedioic acid;bis(pyridine)
CID 155388203
5-hydroxypentanoic acid
CID 25945
octadecanoic acid;pyridine
CID 67593140
10-hydroxydecanoic acid
CID 138734563
38-hydroxyoctatriacontanoic acid
CID 18981443
31-hydroxyhentriacontanoic acid
CID 71339995
hexane-1,6-diol;tetradecanedioic acid
CID 158984327
butane-1,4-diol;hexanedioic acid;bis(hexane-1,6-diol)
CID 161164712
butanedioic acid;butane-1,4-diol;decanedioic acid
CID 175347429
12-hydroxydodecanoic acid;zinc
CID 88673734
lithium;hydride;5-hydroxypentanoic acid
CID 173343870
CID 162333795
CID 162333795

Frequently Asked Questions

What is the IUPAC name of 5-hydroxypentanoic acid;pyridine?
The IUPAC name of 5-hydroxypentanoic acid;pyridine (CID 23505435) is 5-hydroxypentanoic acid;pyridine.
What is the SMILES notation for 5-hydroxypentanoic acid;pyridine?
The canonical SMILES for 5-hydroxypentanoic acid;pyridine is O=C(O)CCCCO.c1ccncc1.
What is the InChIKey of 5-hydroxypentanoic acid;pyridine?
The InChIKey is XZTOLAWQIHJLRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C5H10O3/c1-2-4-6-5-3-1;6-4-2-1-3-5(7)8/h1-5H;6H,1-4H2,(H,7,8).
What are the key properties of 5-hydroxypentanoic acid;pyridine?
5-hydroxypentanoic acid;pyridine has a molecular weight of 197.23 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxypentanoic acid;pyridine is sourced from PubChem (CID 23505435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).