N-[2-(chloromethyl)cyclopentyl]nonanamide

C15H28ClNO — CID 114179441

IUPACN-[2-(chloromethyl)cyclopentyl]nonanamide
SMILESCCCCCCCCC(=O)NC1CCCC1CCl
InChIInChI=1S/C15H28ClNO/c1-2-3-4-5-6-7-11-15(18)17-14-10-8-9-13(14)12-16/h13-14H,2-12H2,1H3,(H,17,18)
InChIKeyHPHCKODICMDICW-UHFFFAOYSA-N
MW273.85 g/mol
LogP4.26
Rot. Bonds9

About N-[2-(chloromethyl)cyclopentyl]nonanamide

N-[2-(chloromethyl)cyclopentyl]nonanamide (PubChem CID 114179441) has the molecular formula C15H28ClNO and a molecular weight of 273.85 g/mol. Its IUPAC name is N-[2-(chloromethyl)cyclopentyl]nonanamide.

Molecular Properties

Compound NameN-[2-(chloromethyl)cyclopentyl]nonanamide
PubChem CID114179441
Molecular FormulaC15H28ClNO
Molecular Weight273.85 g/mol
Exact Mass273.19
IUPAC NameN-[2-(chloromethyl)cyclopentyl]nonanamide
SMILESCCCCCCCCC(=O)NC1CCCC1CCl
InChIInChI=1S/C15H28ClNO/c1-2-3-4-5-6-7-11-15(18)17-14-10-8-9-13(14)12-16/h13-14H,2-12H2,1H3,(H,17,18)
InChIKeyHPHCKODICMDICW-UHFFFAOYSA-N
XLogP4.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.85
LogP ≤ 54.26
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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Related Compounds

N-[2-(chloromethyl)cyclopentyl]butanamide
CID 106365880
N-[2-(hydroxymethyl)cyclopentyl]nonanamide
CID 103774038
N-[2-(dodecanoylamino)cyclohexyl]dodecanamide
CID 10299379
N-(2-chlorocyclopentyl)dodecanamide
CID 106444076
N-(2-chlorocyclopentyl)nonanamide
CID 106443674
N-[[2-(chloromethyl)cyclopentyl]methyl]octanamide
CID 113273844
N-[[2-(chloromethyl)cyclopentyl]methyl]decanamide
CID 114306695
N-[(1R,2R)-2-aminocyclohexyl]decanamide
CID 103805740
N-[2-(aminomethyl)cyclopentyl]pentanamide
CID 62957090
N-[(1R,2R)-2-aminocyclohexyl]nonanamide
CID 103805764
N-(2,3-dimethylcyclohexyl)tridecanamide
CID 57307251
N-[(1R,2R)-2-acetamidocyclohexyl]dodecanamide
CID 158939000

Frequently Asked Questions

What is the IUPAC name of N-[2-(chloromethyl)cyclopentyl]nonanamide?
The IUPAC name of N-[2-(chloromethyl)cyclopentyl]nonanamide (CID 114179441) is N-[2-(chloromethyl)cyclopentyl]nonanamide.
What is the SMILES notation for N-[2-(chloromethyl)cyclopentyl]nonanamide?
The canonical SMILES for N-[2-(chloromethyl)cyclopentyl]nonanamide is CCCCCCCCC(=O)NC1CCCC1CCl.
What is the InChIKey of N-[2-(chloromethyl)cyclopentyl]nonanamide?
The InChIKey is HPHCKODICMDICW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28ClNO/c1-2-3-4-5-6-7-11-15(18)17-14-10-8-9-13(14)12-16/h13-14H,2-12H2,1H3,(H,17,18).
What are the key properties of N-[2-(chloromethyl)cyclopentyl]nonanamide?
N-[2-(chloromethyl)cyclopentyl]nonanamide has a molecular weight of 273.85 g/mol, XLogP of 4.26, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(chloromethyl)cyclopentyl]nonanamide is sourced from PubChem (CID 114179441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).