N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide

C16H17ClN2O2 — CID 60647399

IUPACN-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide
SMILESO=C(CNCCOc1ccccc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c17-13-6-8-14(9-7-13)19-16(20)12-18-10-11-21-15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H,19,20)
InChIKeyUJXAHILLDDGEML-UHFFFAOYSA-N
MW304.78 g/mol
LogP2.95
Rot. Bonds7

About N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide

N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide (PubChem CID 60647399) has the molecular formula C16H17ClN2O2 and a molecular weight of 304.78 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide
PubChem CID60647399
Molecular FormulaC16H17ClN2O2
Molecular Weight304.78 g/mol
Exact Mass304.10
IUPAC NameN-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide
SMILESO=C(CNCCOc1ccccc1)Nc1ccc(Cl)cc1
InChIInChI=1S/C16H17ClN2O2/c17-13-6-8-14(9-7-13)19-16(20)12-18-10-11-21-15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H,19,20)
InChIKeyUJXAHILLDDGEML-UHFFFAOYSA-N
XLogP2.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.78
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chlorophenyl)-2-[2-(4-methoxyphenoxy)ethylamino]acetamide
CID 109005237
N-[2-(4-chloroanilino)-2-oxoethyl]-3-phenoxypropanamide
CID 112997910
2-(2-phenoxyethylamino)acetic acid
CID 13236095
2-[4-(2-phenoxyethoxy)anilino]-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 54823077
N-[4-(2-phenylethoxy)phenyl]-2-(propylamino)acetamide
CID 54818682
N-(4-butoxyphenyl)-2-(2-phenylethylamino)acetamide
CID 54815208
N-(4-chlorophenyl)-2-[methyl(3-phenoxypropyl)amino]acetamide
CID 9040068
2-(2-methoxyethylamino)-N-[3-(2-phenoxyethoxy)phenyl]acetamide
CID 54819962
N-ethyl-2-(2-phenoxyethylamino)acetamide
CID 60674230
N-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(2-methoxyethylamino)acetamide
CID 119738642
N-(4-bromophenyl)-2-[2-(4-methoxyphenoxy)ethylamino]acetamide
CID 109005246
2-(2-chloroanilino)-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 54810242

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide (CID 60647399) is N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide is O=C(CNCCOc1ccccc1)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide?
The InChIKey is UJXAHILLDDGEML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O2/c17-13-6-8-14(9-7-13)19-16(20)12-18-10-11-21-15-4-2-1-3-5-15/h1-9,18H,10-12H2,(H,19,20).
What are the key properties of N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide?
N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide has a molecular weight of 304.78 g/mol, XLogP of 2.95, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(2-phenoxyethylamino)acetamide is sourced from PubChem (CID 60647399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).