N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide

C11H20ClNO2 — CID 102871906

IUPACN-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide
SMILESCCOCC(=O)N(CCCCl)C1CCC1
InChIInChI=1S/C11H20ClNO2/c1-2-15-9-11(14)13(8-4-7-12)10-5-3-6-10/h10H,2-9H2,1H3
InChIKeyUSELKIBOPPREKZ-UHFFFAOYSA-N
MW233.74 g/mol
LogP2.03
Rot. Bonds7

About N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide

N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide (PubChem CID 102871906) has the molecular formula C11H20ClNO2 and a molecular weight of 233.74 g/mol. Its IUPAC name is N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide.

Molecular Properties

Compound NameN-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide
PubChem CID102871906
Molecular FormulaC11H20ClNO2
Molecular Weight233.74 g/mol
Exact Mass233.12
IUPAC NameN-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide
SMILESCCOCC(=O)N(CCCCl)C1CCC1
InChIInChI=1S/C11H20ClNO2/c1-2-15-9-11(14)13(8-4-7-12)10-5-3-6-10/h10H,2-9H2,1H3
InChIKeyUSELKIBOPPREKZ-UHFFFAOYSA-N
XLogP2.03
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(3-chloropropyl)-N-cyclobutylbutanamide
CID 102872148
N-(2-bromoethyl)-N-cyclohexyl-2-ethoxyacetamide
CID 80659612
N-(3-chloropropyl)-N-cyclobutyl-3-(2,2,2-trifluoroethoxy)propanamide
CID 103212868
2-(3-chlorophenoxy)-N-(3-chloropropyl)-N-cyclobutylacetamide
CID 102872110
N-cyclobutyl-N-(3-hydroxypropyl)-2-methoxyacetamide
CID 102866415
N-(3-chloropropyl)-N-cyclobutyl-2-(4-methylphenyl)acetamide
CID 102871873
N-(3-chloropropyl)-N-cyclobutyl-2-ethoxybenzamide
CID 102871986
N-butyl-N-(2-chloroethyl)-2-ethoxyacetamide
CID 63391075
N-(2-chloroethyl)-N-cyclobutyl-2-phenoxyacetamide
CID 102872589
N-(3-aminopropyl)-N-cyclopentyl-3-ethoxypropanamide
CID 62588970
N-(2-amino-2-hydroxyiminoethyl)-N-cyclopentyl-2-ethoxyacetamide
CID 77044603
N-(3-amino-3-hydroxyiminopropyl)-N-cyclopropyl-2-ethoxyacetamide
CID 76911812

Frequently Asked Questions

What is the IUPAC name of N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide?
The IUPAC name of N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide (CID 102871906) is N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide.
What is the SMILES notation for N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide?
The canonical SMILES for N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide is CCOCC(=O)N(CCCCl)C1CCC1.
What is the InChIKey of N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide?
The InChIKey is USELKIBOPPREKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20ClNO2/c1-2-15-9-11(14)13(8-4-7-12)10-5-3-6-10/h10H,2-9H2,1H3.
What are the key properties of N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide?
N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide has a molecular weight of 233.74 g/mol, XLogP of 2.03, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloropropyl)-N-cyclobutyl-2-ethoxyacetamide is sourced from PubChem (CID 102871906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).