4-hydroxy-N-nonylpentanamide

C14H29NO2 — CID 2828250

IUPAC4-hydroxy-N-nonylpentanamide
SMILESCCCCCCCCCNC(=O)CCC(C)O
InChIInChI=1S/C14H29NO2/c1-3-4-5-6-7-8-9-12-15-14(17)11-10-13(2)16/h13,16H,3-12H2,1-2H3,(H,15,17)
InChIKeyPQYMRHJTUATPQL-UHFFFAOYSA-N
MW243.39 g/mol
LogP3.01
Rot. Bonds11

About 4-hydroxy-N-nonylpentanamide

4-hydroxy-N-nonylpentanamide (PubChem CID 2828250) has the molecular formula C14H29NO2 and a molecular weight of 243.39 g/mol. Its IUPAC name is 4-hydroxy-N-nonylpentanamide.

Molecular Properties

Compound Name4-hydroxy-N-nonylpentanamide
PubChem CID2828250
Molecular FormulaC14H29NO2
Molecular Weight243.39 g/mol
Exact Mass243.22
IUPAC Name4-hydroxy-N-nonylpentanamide
SMILESCCCCCCCCCNC(=O)CCC(C)O
InChIInChI=1S/C14H29NO2/c1-3-4-5-6-7-8-9-12-15-14(17)11-10-13(2)16/h13,16H,3-12H2,1-2H3,(H,15,17)
InChIKeyPQYMRHJTUATPQL-UHFFFAOYSA-N
XLogP3.01
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.39
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-nonylpentanamide?
The IUPAC name of 4-hydroxy-N-nonylpentanamide (CID 2828250) is 4-hydroxy-N-nonylpentanamide.
What is the SMILES notation for 4-hydroxy-N-nonylpentanamide?
The canonical SMILES for 4-hydroxy-N-nonylpentanamide is CCCCCCCCCNC(=O)CCC(C)O.
What is the InChIKey of 4-hydroxy-N-nonylpentanamide?
The InChIKey is PQYMRHJTUATPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO2/c1-3-4-5-6-7-8-9-12-15-14(17)11-10-13(2)16/h13,16H,3-12H2,1-2H3,(H,15,17).
What are the key properties of 4-hydroxy-N-nonylpentanamide?
4-hydroxy-N-nonylpentanamide has a molecular weight of 243.39 g/mol, XLogP of 3.01, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-nonylpentanamide is sourced from PubChem (CID 2828250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).