N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide

C11H13ClFNO2 — CID 79199616

IUPACN-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide
SMILESO=C(CCCCO)Nc1cc(Cl)ccc1F
InChIInChI=1S/C11H13ClFNO2/c12-8-4-5-9(13)10(7-8)14-11(16)3-1-2-6-15/h4-5,7,15H,1-3,6H2,(H,14,16)
InChIKeySBXLRDXYTCGKKB-UHFFFAOYSA-N
MW245.68 g/mol
LogP2.58
Rot. Bonds5

About N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide

N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide (PubChem CID 79199616) has the molecular formula C11H13ClFNO2 and a molecular weight of 245.68 g/mol. Its IUPAC name is N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide.

Molecular Properties

Compound NameN-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide
PubChem CID79199616
Molecular FormulaC11H13ClFNO2
Molecular Weight245.68 g/mol
Exact Mass245.06
IUPAC NameN-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide
SMILESO=C(CCCCO)Nc1cc(Cl)ccc1F
InChIInChI=1S/C11H13ClFNO2/c12-8-4-5-9(13)10(7-8)14-11(16)3-1-2-6-15/h4-5,7,15H,1-3,6H2,(H,14,16)
InChIKeySBXLRDXYTCGKKB-UHFFFAOYSA-N
XLogP2.58
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.68
LogP ≤ 52.58
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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Related Compounds

N-(5-chloro-2-fluorophenyl)-3-hydroxypropanamide
CID 115138756
5-(5-chloro-2-fluoroanilino)-5-oxopentanoic acid
CID 43396605
N-(5-chloro-2-fluorophenyl)-2-hydroxyacetamide
CID 16769009
N-(2-fluorophenyl)-5-hydroxypentanamide
CID 79019059
N-(4-chloro-2-fluorophenyl)heptanamide
CID 4055752
N-(4-chloro-2-fluorophenyl)dodecanamide
CID 4598315
N-(5-chloro-2-fluorophenyl)-4-(4-fluorophenoxy)butanamide
CID 46535270
N-(5-chloro-2-propoxyphenyl)-5-hydroxypentanamide
CID 79199775
N-(2,5-dichlorophenyl)hexanamide
CID 5055577
5-chloro-N-(2,5-difluorophenyl)pentanamide
CID 28971528
N-(5-chloro-2-fluorophenyl)-2-[(S)-2-hydroxyethylsulfinyl]acetamide
CID 97340008
N-(2,5-dichlorophenyl)heptanamide
CID 3294645

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide?
The IUPAC name of N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide (CID 79199616) is N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide.
What is the SMILES notation for N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide?
The canonical SMILES for N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide is O=C(CCCCO)Nc1cc(Cl)ccc1F.
What is the InChIKey of N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide?
The InChIKey is SBXLRDXYTCGKKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClFNO2/c12-8-4-5-9(13)10(7-8)14-11(16)3-1-2-6-15/h4-5,7,15H,1-3,6H2,(H,14,16).
What are the key properties of N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide?
N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide has a molecular weight of 245.68 g/mol, XLogP of 2.58, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-fluorophenyl)-5-hydroxypentanamide is sourced from PubChem (CID 79199616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).