N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide

C19H21ClN2O4 — CID 25470676

IUPACN-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide
SMILESCCOc1ccccc1OCCC(=O)Nc1ccc(NC(C)=O)c(Cl)c1
InChIInChI=1S/C19H21ClN2O4/c1-3-25-17-6-4-5-7-18(17)26-11-10-19(24)22-14-8-9-16(15(20)12-14)21-13(2)23/h4-9,12H,3,10-11H2,1-2H3,(H,21,23)(H,22,24)
InChIKeySORLAFDAPKVVND-UHFFFAOYSA-N
MW376.84 g/mol
LogP4.10
Rot. Bonds8

About N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide

N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide (PubChem CID 25470676) has the molecular formula C19H21ClN2O4 and a molecular weight of 376.84 g/mol. Its IUPAC name is N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide
PubChem CID25470676
Molecular FormulaC19H21ClN2O4
Molecular Weight376.84 g/mol
Exact Mass376.12
IUPAC NameN-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide
SMILESCCOc1ccccc1OCCC(=O)Nc1ccc(NC(C)=O)c(Cl)c1
InChIInChI=1S/C19H21ClN2O4/c1-3-25-17-6-4-5-7-18(17)26-11-10-19(24)22-14-8-9-16(15(20)12-14)21-13(2)23/h4-9,12H,3,10-11H2,1-2H3,(H,21,23)(H,22,24)
InChIKeySORLAFDAPKVVND-UHFFFAOYSA-N
XLogP4.10
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.84
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminophenyl)-3-(2-ethoxyphenoxy)propanamide
CID 43825399
N-(4-chloro-2-methylphenyl)-3-(2-ethoxyphenoxy)propanamide
CID 17425680
N-(4-acetamido-3-chlorophenyl)-3-chloropropanamide
CID 43167983
N-(1,3-benzodioxol-5-yl)-3-(2-ethoxyphenoxy)propanamide
CID 2082414
2-(4-acetamido-3-chloroanilino)-N-(2-ethoxyphenyl)propanamide
CID 47018355
N-(5-acetamido-2-fluorophenyl)-4-(2-ethoxyphenoxy)butanamide
CID 55552164
N-(3-chloro-4-methoxyphenyl)-3-(2-methylphenoxy)propanamide
CID 2110283
[2-(3-chloro-4-cyanoanilino)-2-oxoethyl] 3-(2-ethoxyphenoxy)propanoate
CID 7856589
N-(2,3-dichlorophenyl)-4-(2-ethoxyphenoxy)butanamide
CID 26364358
N-(3-chloro-4-fluorophenyl)-2-(2-ethoxyphenoxy)acetamide
CID 2578584
3-(2-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 39087955
2-[2-(2-chlorophenoxy)ethyl-methylamino]-N-(3,4-diethoxyphenyl)acetamide
CID 27122687

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide?
The IUPAC name of N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide (CID 25470676) is N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide.
What is the SMILES notation for N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide?
The canonical SMILES for N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide is CCOc1ccccc1OCCC(=O)Nc1ccc(NC(C)=O)c(Cl)c1.
What is the InChIKey of N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide?
The InChIKey is SORLAFDAPKVVND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O4/c1-3-25-17-6-4-5-7-18(17)26-11-10-19(24)22-14-8-9-16(15(20)12-14)21-13(2)23/h4-9,12H,3,10-11H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide?
N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide has a molecular weight of 376.84 g/mol, XLogP of 4.10, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-3-chlorophenyl)-3-(2-ethoxyphenoxy)propanamide is sourced from PubChem (CID 25470676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).