5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide

C14H20ClNO3 — CID 43701603

IUPAC5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide
SMILESCOCCOc1ccc(NC(=O)CCCCCl)cc1
InChIInChI=1S/C14H20ClNO3/c1-18-10-11-19-13-7-5-12(6-8-13)16-14(17)4-2-3-9-15/h5-8H,2-4,9-11H2,1H3,(H,16,17)
InChIKeySBGQOQOSRDTFJR-UHFFFAOYSA-N
MW285.77 g/mol
LogP3.06
Rot. Bonds9

About 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide

5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide (PubChem CID 43701603) has the molecular formula C14H20ClNO3 and a molecular weight of 285.77 g/mol. Its IUPAC name is 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide.

Molecular Properties

Compound Name5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide
PubChem CID43701603
Molecular FormulaC14H20ClNO3
Molecular Weight285.77 g/mol
Exact Mass285.11
IUPAC Name5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide
SMILESCOCCOc1ccc(NC(=O)CCCCCl)cc1
InChIInChI=1S/C14H20ClNO3/c1-18-10-11-19-13-7-5-12(6-8-13)16-14(17)4-2-3-9-15/h5-8H,2-4,9-11H2,1H3,(H,16,17)
InChIKeySBGQOQOSRDTFJR-UHFFFAOYSA-N
XLogP3.06
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.77
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(2-hydroxyethoxy)phenyl]-4-methoxybutanamide
CID 139895558
5-chloro-N-[6-(2-methoxyethoxy)-3-pyridinyl]pentanamide
CID 43697910
3-chloro-N-(4-propoxyphenyl)propanamide
CID 62329515
methyl 4-(5-chloropentanoylamino)benzoate
CID 11507300
methyl 3-[4-(2-methoxyethoxy)anilino]-3-oxopropanoate
CID 28638031
N-[4-(2-methoxyethoxy)phenyl]-3-propan-2-yloxypropanamide
CID 86981512
5-chloro-N-(4-phenoxyphenyl)pentanamide
CID 28971507
N-[4-(2-ethenoxyethoxy)phenyl]pentanamide
CID 102477298
N-[4-(3-chloropropoxy)phenyl]-3-propoxypropanamide
CID 139895559
N-[[4-(2-methoxyethoxy)phenyl]carbamothioyl]hexanamide
CID 17340586
N,N'-bis(4-ethoxyphenyl)nonanediamide
CID 4507995
N-(4-butoxyphenyl)butanamide
CID 4939679

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide?
The IUPAC name of 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide (CID 43701603) is 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide.
What is the SMILES notation for 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide?
The canonical SMILES for 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide is COCCOc1ccc(NC(=O)CCCCCl)cc1.
What is the InChIKey of 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide?
The InChIKey is SBGQOQOSRDTFJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO3/c1-18-10-11-19-13-7-5-12(6-8-13)16-14(17)4-2-3-9-15/h5-8H,2-4,9-11H2,1H3,(H,16,17).
What are the key properties of 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide?
5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide has a molecular weight of 285.77 g/mol, XLogP of 3.06, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[4-(2-methoxyethoxy)phenyl]pentanamide is sourced from PubChem (CID 43701603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).