N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide

C19H21Cl2N3O3 — CID 17447633

IUPACN-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)CNC(C)c1ccc(Cl)cc1Cl
InChIInChI=1S/C19H21Cl2N3O3/c1-11(15-6-4-13(20)8-16(15)21)22-10-19(26)24-17-9-14(23-12(2)25)5-7-18(17)27-3/h4-9,11,22H,10H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyCTNMFILDDPQPIX-UHFFFAOYSA-N
MW410.30 g/mol
LogP4.25
Rot. Bonds7

About N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide

N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide (PubChem CID 17447633) has the molecular formula C19H21Cl2N3O3 and a molecular weight of 410.30 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide
PubChem CID17447633
Molecular FormulaC19H21Cl2N3O3
Molecular Weight410.30 g/mol
Exact Mass409.10
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)CNC(C)c1ccc(Cl)cc1Cl
InChIInChI=1S/C19H21Cl2N3O3/c1-11(15-6-4-13(20)8-16(15)21)22-10-19(26)24-17-9-14(23-12(2)25)5-7-18(17)27-3/h4-9,11,22H,10H2,1-3H3,(H,23,25)(H,24,26)
InChIKeyCTNMFILDDPQPIX-UHFFFAOYSA-N
XLogP4.25
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.30
LogP ≤ 54.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[1-(2,4-dichlorophenyl)ethylamino]-N-(2-methoxyphenyl)acetamide
CID 84964111
N-(5-acetamido-2-methoxyphenyl)-2-[[(1R)-1-(3-chlorophenyl)ethyl]amino]acetamide
CID 8599537
N-(5-chloro-2-methoxyphenyl)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 9307080
N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]propanamide
CID 46527155
N-(5-acetamido-2-methoxyphenyl)-2-[1-(2-fluorophenyl)ethylamino]acetamide
CID 18088438
4-[[2-[[(1R)-1-(2,4-dichlorophenyl)ethyl]amino]acetyl]amino]-N-(2-methoxyphenyl)benzamide
CID 40941991
N-(2-chlorophenyl)-2-[[(1S)-1-(2,4-dichlorophenyl)ethyl]amino]acetamide
CID 9253950
N-(5-acetamido-2-methoxyphenyl)-2-(2,5-dichlorophenoxy)acetamide
CID 8578537
N-(3-chloro-4-methoxyphenyl)-2-[[(1S)-1-(2-chlorophenyl)ethyl]amino]acetamide
CID 9306824
N-(2-acetylphenyl)-2-[[(1S)-1-(2,4-dichlorophenyl)ethyl]amino]acetamide
CID 9254442
2-(5-acetamido-2-fluoroanilino)-N-(5-acetamido-2-methoxyphenyl)acetamide
CID 37279177
2-[[(1S)-1-(2,4-dichlorophenyl)ethyl]amino]-N-(2-ethylphenyl)acetamide
CID 9253790

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide (CID 17447633) is N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide is COc1ccc(NC(C)=O)cc1NC(=O)CNC(C)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide?
The InChIKey is CTNMFILDDPQPIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21Cl2N3O3/c1-11(15-6-4-13(20)8-16(15)21)22-10-19(26)24-17-9-14(23-12(2)25)5-7-18(17)27-3/h4-9,11,22H,10H2,1-3H3,(H,23,25)(H,24,26).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide?
N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide has a molecular weight of 410.30 g/mol, XLogP of 4.25, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-[1-(2,4-dichlorophenyl)ethylamino]acetamide is sourced from PubChem (CID 17447633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).