2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide

C11H14ClNO2 — CID 53416981

IUPAC2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide
SMILESCCN(C(=O)CCl)c1ccc(OC)cc1
InChIInChI=1S/C11H14ClNO2/c1-3-13(11(14)8-12)9-4-6-10(15-2)7-5-9/h4-7H,3,8H2,1-2H3
InChIKeyRHTNTFQTZQFXBM-UHFFFAOYSA-N
MW227.69 g/mol
LogP2.29
Rot. Bonds4

About 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide

2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide (PubChem CID 53416981) has the molecular formula C11H14ClNO2 and a molecular weight of 227.69 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide
PubChem CID53416981
Molecular FormulaC11H14ClNO2
Molecular Weight227.69 g/mol
Exact Mass227.07
IUPAC Name2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide
SMILESCCN(C(=O)CCl)c1ccc(OC)cc1
InChIInChI=1S/C11H14ClNO2/c1-3-13(11(14)8-12)9-4-6-10(15-2)7-5-9/h4-7H,3,8H2,1-2H3
InChIKeyRHTNTFQTZQFXBM-UHFFFAOYSA-N
XLogP2.29
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 52.29
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

2-chloro-N-(4-chlorophenyl)-N-ethylacetamide
CID 15045863
2-chloro-N-(4-methoxyphenyl)-N-methylacetamide
CID 4714233
2-chloro-N-(4-fluorophenyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 39442873
N-ethyl-2-(4-methoxyphenoxy)-N-phenylacetamide
CID 922695
N-ethyl-N-(4-fluorophenyl)-2-(4-methoxyphenyl)sulfanylacetamide
CID 55380115
N-ethyl-2-[2-(4-methoxyphenyl)ethylamino]-N-phenylacetamide
CID 109001184
N-ethyl-5-(4-methoxyphenyl)-5-oxo-N-phenylpentanamide
CID 110298239
2-(N-butanoyl-4-methoxyanilino)acetic acid
CID 28765925
ethyl 3-(N-(2-ethoxy-2-oxoethyl)-4-methoxyanilino)-3-oxopropanoate
CID 46398234
2-chloro-N-(3-fluorophenyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 39442898
N-ethyl-N-(4-methoxyphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 20949216
[2-(N-ethylanilino)-2-oxoethyl] 3-(4-methoxyphenoxy)propanoate
CID 2375807

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide (CID 53416981) is 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide is CCN(C(=O)CCl)c1ccc(OC)cc1.
What is the InChIKey of 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide?
The InChIKey is RHTNTFQTZQFXBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO2/c1-3-13(11(14)8-12)9-4-6-10(15-2)7-5-9/h4-7H,3,8H2,1-2H3.
What are the key properties of 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide?
2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide has a molecular weight of 227.69 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 53416981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).