2-(3-chlorophenyl)-2-hydroxynonanamide

C15H22ClNO2 — CID 10039502

IUPAC2-(3-chlorophenyl)-2-hydroxynonanamide
SMILESCCCCCCCC(O)(C(N)=O)c1cccc(Cl)c1
InChIInChI=1S/C15H22ClNO2/c1-2-3-4-5-6-10-15(19,14(17)18)12-8-7-9-13(16)11-12/h7-9,11,19H,2-6,10H2,1H3,(H2,17,18)
InChIKeyYAKWOONSXDDYMF-UHFFFAOYSA-N
MW283.80 g/mol
LogP3.37
Rot. Bonds8

About 2-(3-chlorophenyl)-2-hydroxynonanamide

2-(3-chlorophenyl)-2-hydroxynonanamide (PubChem CID 10039502) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-2-hydroxynonanamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-2-hydroxynonanamide
PubChem CID10039502
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC Name2-(3-chlorophenyl)-2-hydroxynonanamide
SMILESCCCCCCCC(O)(C(N)=O)c1cccc(Cl)c1
InChIInChI=1S/C15H22ClNO2/c1-2-3-4-5-6-10-15(19,14(17)18)12-8-7-9-13(16)11-12/h7-9,11,19H,2-6,10H2,1H3,(H2,17,18)
InChIKeyYAKWOONSXDDYMF-UHFFFAOYSA-N
XLogP3.37
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 53.37
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 2-(3-chlorophenyl)-2-hydroxynonanamide?
The IUPAC name of 2-(3-chlorophenyl)-2-hydroxynonanamide (CID 10039502) is 2-(3-chlorophenyl)-2-hydroxynonanamide.
What is the SMILES notation for 2-(3-chlorophenyl)-2-hydroxynonanamide?
The canonical SMILES for 2-(3-chlorophenyl)-2-hydroxynonanamide is CCCCCCCC(O)(C(N)=O)c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-2-hydroxynonanamide?
The InChIKey is YAKWOONSXDDYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c1-2-3-4-5-6-10-15(19,14(17)18)12-8-7-9-13(16)11-12/h7-9,11,19H,2-6,10H2,1H3,(H2,17,18).
What are the key properties of 2-(3-chlorophenyl)-2-hydroxynonanamide?
2-(3-chlorophenyl)-2-hydroxynonanamide has a molecular weight of 283.80 g/mol, XLogP of 3.37, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-2-hydroxynonanamide is sourced from PubChem (CID 10039502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).