N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide

C17H19N3O3 — CID 33152476

IUPACN-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ccc(NC(N)=O)cc2)cc1
InChIInChI=1S/C17H19N3O3/c1-2-12-3-9-15(10-4-12)23-11-16(21)19-13-5-7-14(8-6-13)20-17(18)22/h3-10H,2,11H2,1H3,(H,19,21)(H3,18,20,22)
InChIKeyBZMRVFRVSHSSML-UHFFFAOYSA-N
MW313.36 g/mol
LogP2.76
Rot. Bonds6

About N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide

N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide (PubChem CID 33152476) has the molecular formula C17H19N3O3 and a molecular weight of 313.36 g/mol. Its IUPAC name is N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide
PubChem CID33152476
Molecular FormulaC17H19N3O3
Molecular Weight313.36 g/mol
Exact Mass313.14
IUPAC NameN-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide
SMILESCCc1ccc(OCC(=O)Nc2ccc(NC(N)=O)cc2)cc1
InChIInChI=1S/C17H19N3O3/c1-2-12-3-9-15(10-4-12)23-11-16(21)19-13-5-7-14(8-6-13)20-17(18)22/h3-10H,2,11H2,1H3,(H,19,21)(H3,18,20,22)
InChIKeyBZMRVFRVSHSSML-UHFFFAOYSA-N
XLogP2.76
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 52.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-aminophenoxy)-N-(4-ethylphenyl)acetamide
CID 39107615
N-(4-ethylphenyl)-2-(4-fluorophenoxy)acetamide
CID 893586
2-[4-[[2-(4-ethylphenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35364935
propyl 4-[[2-(4-ethylphenoxy)acetyl]amino]benzoate
CID 2274683
2-(4-anilinophenoxy)-N-(4-ethylphenyl)acetamide
CID 2559894
2-(4-ethylphenoxy)-N-[4-(2-phenoxyethoxy)phenyl]acetamide
CID 4958186
[2-(4-ethoxyanilino)-2-oxoethyl] 2-(4-ethylphenoxy)acetate
CID 9272649
N-(4-ethylphenyl)-2-[4-(1-hydroxypropyl)phenoxy]acetamide
CID 86919939
N,N-diethyl-4-[[2-(4-ethylphenoxy)acetyl]amino]benzamide
CID 8503993
2-(4-ethylphenoxy)-N-[4-(propylsulfamoyl)phenyl]acetamide
CID 4932605
N-(3,4-dichlorophenyl)-2-(4-ethylphenoxy)acetamide
CID 706860
[2-(4-ethylanilino)-2-oxoethyl] 2-(4-propanoylphenoxy)acetate
CID 9326799

Frequently Asked Questions

What is the IUPAC name of N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide?
The IUPAC name of N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide (CID 33152476) is N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide.
What is the SMILES notation for N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide?
The canonical SMILES for N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide is CCc1ccc(OCC(=O)Nc2ccc(NC(N)=O)cc2)cc1.
What is the InChIKey of N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide?
The InChIKey is BZMRVFRVSHSSML-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-2-12-3-9-15(10-4-12)23-11-16(21)19-13-5-7-14(8-6-13)20-17(18)22/h3-10H,2,11H2,1H3,(H,19,21)(H3,18,20,22).
What are the key properties of N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide?
N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide has a molecular weight of 313.36 g/mol, XLogP of 2.76, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(carbamoylamino)phenyl]-2-(4-ethylphenoxy)acetamide is sourced from PubChem (CID 33152476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).