2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide

C15H20ClNO2 — CID 63826472

IUPAC2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide
SMILESO=C(NCCOC1CCCC1)C(Cl)c1ccccc1
InChIInChI=1S/C15H20ClNO2/c16-14(12-6-2-1-3-7-12)15(18)17-10-11-19-13-8-4-5-9-13/h1-3,6-7,13-14H,4-5,8-11H2,(H,17,18)
InChIKeyRGUVBOJNRLAFHT-UHFFFAOYSA-N
MW281.78 g/mol
LogP3.04
Rot. Bonds6

About 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide

2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide (PubChem CID 63826472) has the molecular formula C15H20ClNO2 and a molecular weight of 281.78 g/mol. Its IUPAC name is 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide.

Molecular Properties

Compound Name2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide
PubChem CID63826472
Molecular FormulaC15H20ClNO2
Molecular Weight281.78 g/mol
Exact Mass281.12
IUPAC Name2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide
SMILESO=C(NCCOC1CCCC1)C(Cl)c1ccccc1
InChIInChI=1S/C15H20ClNO2/c16-14(12-6-2-1-3-7-12)15(18)17-10-11-19-13-8-4-5-9-13/h1-3,6-7,13-14H,4-5,8-11H2,(H,17,18)
InChIKeyRGUVBOJNRLAFHT-UHFFFAOYSA-N
XLogP3.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.78
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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

2-amino-N-(2-cycloheptyloxyethyl)-2-phenylacetamide;hydrochloride
CID 119325370
3-amino-N-(2-cyclopentyloxyethyl)-2-phenylpropanamide;hydrochloride
CID 119737692
2-(3-aminophenyl)-N-(2-cyclopentyloxyethyl)propanamide
CID 106591466
2-chloro-N-cyclopentyloxy-2-phenylacetamide
CID 83228662
2-[2-[(2-cyclopentyloxyethylamino)methyl]phenyl]acetic acid
CID 115461994
2-chloro-N-[3-(2-methoxyethoxy)propyl]-2-phenylacetamide
CID 61251247
2-(2-cyclohexyloxyethylamino)-1-phenylethanol
CID 55259175
2-chloro-N-[3-(oxolan-2-ylmethoxy)propyl]-2-phenylacetamide
CID 61251530
3-[(2-chloro-2-phenylacetyl)amino]-N-(2-methoxyethyl)propanamide
CID 115649428
2-bromo-N-(2-cyclopentyloxyethyl)benzamide
CID 55151515
2-chloro-N-cyclohexyl-2-phenylacetamide
CID 11032339
2-chloro-N-[2-[methyl(propan-2-yl)amino]ethyl]-2-phenylacetamide
CID 62640904

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide?
The IUPAC name of 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide (CID 63826472) is 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide.
What is the SMILES notation for 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide?
The canonical SMILES for 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide is O=C(NCCOC1CCCC1)C(Cl)c1ccccc1.
What is the InChIKey of 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide?
The InChIKey is RGUVBOJNRLAFHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO2/c16-14(12-6-2-1-3-7-12)15(18)17-10-11-19-13-8-4-5-9-13/h1-3,6-7,13-14H,4-5,8-11H2,(H,17,18).
What are the key properties of 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide?
2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide has a molecular weight of 281.78 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(2-cyclopentyloxyethyl)-2-phenylacetamide is sourced from PubChem (CID 63826472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).