N-(2-chlorocyclopentyl)nonanamide

C14H26ClNO — CID 106443674

IUPACN-(2-chlorocyclopentyl)nonanamide
SMILESCCCCCCCCC(=O)NC1CCCC1Cl
InChIInChI=1S/C14H26ClNO/c1-2-3-4-5-6-7-11-14(17)16-13-10-8-9-12(13)15/h12-13H,2-11H2,1H3,(H,16,17)
InChIKeyJSDMGIKWYVNVDN-UHFFFAOYSA-N
MW259.82 g/mol
LogP4.01
Rot. Bonds8

About N-(2-chlorocyclopentyl)nonanamide

N-(2-chlorocyclopentyl)nonanamide (PubChem CID 106443674) has the molecular formula C14H26ClNO and a molecular weight of 259.82 g/mol. Its IUPAC name is N-(2-chlorocyclopentyl)nonanamide.

Molecular Properties

Compound NameN-(2-chlorocyclopentyl)nonanamide
PubChem CID106443674
Molecular FormulaC14H26ClNO
Molecular Weight259.82 g/mol
Exact Mass259.17
IUPAC NameN-(2-chlorocyclopentyl)nonanamide
SMILESCCCCCCCCC(=O)NC1CCCC1Cl
InChIInChI=1S/C14H26ClNO/c1-2-3-4-5-6-7-11-14(17)16-13-10-8-9-12(13)15/h12-13H,2-11H2,1H3,(H,16,17)
InChIKeyJSDMGIKWYVNVDN-UHFFFAOYSA-N
XLogP4.01
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.82
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorocyclopentyl)nonanamide?
The IUPAC name of N-(2-chlorocyclopentyl)nonanamide (CID 106443674) is N-(2-chlorocyclopentyl)nonanamide.
What is the SMILES notation for N-(2-chlorocyclopentyl)nonanamide?
The canonical SMILES for N-(2-chlorocyclopentyl)nonanamide is CCCCCCCCC(=O)NC1CCCC1Cl.
What is the InChIKey of N-(2-chlorocyclopentyl)nonanamide?
The InChIKey is JSDMGIKWYVNVDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26ClNO/c1-2-3-4-5-6-7-11-14(17)16-13-10-8-9-12(13)15/h12-13H,2-11H2,1H3,(H,16,17).
What are the key properties of N-(2-chlorocyclopentyl)nonanamide?
N-(2-chlorocyclopentyl)nonanamide has a molecular weight of 259.82 g/mol, XLogP of 4.01, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorocyclopentyl)nonanamide is sourced from PubChem (CID 106443674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).