N-(2-chloro-4-hydroxyphenyl)nonanamide

C15H22ClNO2 — CID 65427497

IUPACN-(2-chloro-4-hydroxyphenyl)nonanamide
SMILESCCCCCCCCC(=O)Nc1ccc(O)cc1Cl
InChIInChI=1S/C15H22ClNO2/c1-2-3-4-5-6-7-8-15(19)17-14-10-9-12(18)11-13(14)16/h9-11,18H,2-8H2,1H3,(H,17,19)
InChIKeyPNRSSBCCYYZQLF-UHFFFAOYSA-N
MW283.80 g/mol
LogP4.73
Rot. Bonds8

About N-(2-chloro-4-hydroxyphenyl)nonanamide

N-(2-chloro-4-hydroxyphenyl)nonanamide (PubChem CID 65427497) has the molecular formula C15H22ClNO2 and a molecular weight of 283.80 g/mol. Its IUPAC name is N-(2-chloro-4-hydroxyphenyl)nonanamide.

Molecular Properties

Compound NameN-(2-chloro-4-hydroxyphenyl)nonanamide
PubChem CID65427497
Molecular FormulaC15H22ClNO2
Molecular Weight283.80 g/mol
Exact Mass283.13
IUPAC NameN-(2-chloro-4-hydroxyphenyl)nonanamide
SMILESCCCCCCCCC(=O)Nc1ccc(O)cc1Cl
InChIInChI=1S/C15H22ClNO2/c1-2-3-4-5-6-7-8-15(19)17-14-10-9-12(18)11-13(14)16/h9-11,18H,2-8H2,1H3,(H,17,19)
InChIKeyPNRSSBCCYYZQLF-UHFFFAOYSA-N
XLogP4.73
TPSA49.33 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 ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-hydroxyphenyl)nonanamide?
The IUPAC name of N-(2-chloro-4-hydroxyphenyl)nonanamide (CID 65427497) is N-(2-chloro-4-hydroxyphenyl)nonanamide.
What is the SMILES notation for N-(2-chloro-4-hydroxyphenyl)nonanamide?
The canonical SMILES for N-(2-chloro-4-hydroxyphenyl)nonanamide is CCCCCCCCC(=O)Nc1ccc(O)cc1Cl.
What is the InChIKey of N-(2-chloro-4-hydroxyphenyl)nonanamide?
The InChIKey is PNRSSBCCYYZQLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClNO2/c1-2-3-4-5-6-7-8-15(19)17-14-10-9-12(18)11-13(14)16/h9-11,18H,2-8H2,1H3,(H,17,19).
What are the key properties of N-(2-chloro-4-hydroxyphenyl)nonanamide?
N-(2-chloro-4-hydroxyphenyl)nonanamide has a molecular weight of 283.80 g/mol, XLogP of 4.73, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-hydroxyphenyl)nonanamide is sourced from PubChem (CID 65427497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).