N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide

C17H19N3O4 — CID 108892060

IUPACN-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide
SMILESCOc1ccccc1OCNC(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C17H19N3O4/c1-12(21)19-13-7-9-14(10-8-13)20-17(22)18-11-24-16-6-4-3-5-15(16)23-2/h3-10H,11H2,1-2H3,(H,19,21)(H2,18,20,22)
InChIKeySDWUGZWZTNGSFF-UHFFFAOYSA-N
MW329.36 g/mol
LogP2.81
Rot. Bonds6

About N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide

N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide (PubChem CID 108892060) has the molecular formula C17H19N3O4 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide
PubChem CID108892060
Molecular FormulaC17H19N3O4
Molecular Weight329.36 g/mol
Exact Mass329.14
IUPAC NameN-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide
SMILESCOc1ccccc1OCNC(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C17H19N3O4/c1-12(21)19-13-7-9-14(10-8-13)20-17(22)18-11-24-16-6-4-3-5-15(16)23-2/h3-10H,11H2,1-2H3,(H,19,21)(H2,18,20,22)
InChIKeySDWUGZWZTNGSFF-UHFFFAOYSA-N
XLogP2.81
TPSA88.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 52.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-bromophenyl)-3-[(2-methoxyphenoxy)methyl]urea
CID 108892052
1-(4-ethylphenyl)-3-[(2-methoxyphenoxy)methyl]urea
CID 108892216
1-(4-ethoxyphenyl)-3-[(2-methoxyphenoxy)methyl]urea
CID 108892159
N-[2-[(2-methoxyphenoxy)methylcarbamoylamino]ethyl]acetamide
CID 108892313
1-(2-bromophenyl)-3-[(2-methoxyphenoxy)methyl]urea
CID 108892327
1-(4-tert-butylphenyl)-3-[(2-ethoxyphenoxy)methyl]urea
CID 108877331
1-[3-(2-methoxyphenoxy)propyl]-3-phenylurea
CID 91538470
1-(2-methoxy-5-methylphenyl)-3-[(2-methoxyphenoxy)methyl]urea
CID 108892166
N-[4-[[[2-(2-methoxyphenoxy)acetyl]amino]sulfamoyl]phenyl]acetamide
CID 8506456
1-[(2-ethylphenoxy)methyl]-3-phenylurea
CID 108893317
1-[(2-ethylphenoxy)methyl]-3-(4-fluorophenyl)urea
CID 108893256
N-[2-methoxy-4-[2-(2-methoxyphenoxy)ethylcarbamoylamino]phenyl]acetamide
CID 55744137

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide?
The IUPAC name of N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide (CID 108892060) is N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide is COc1ccccc1OCNC(=O)Nc1ccc(NC(C)=O)cc1.
What is the InChIKey of N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide?
The InChIKey is SDWUGZWZTNGSFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4/c1-12(21)19-13-7-9-14(10-8-13)20-17(22)18-11-24-16-6-4-3-5-15(16)23-2/h3-10H,11H2,1-2H3,(H,19,21)(H2,18,20,22).
What are the key properties of N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide?
N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide has a molecular weight of 329.36 g/mol, XLogP of 2.81, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methoxyphenoxy)methylcarbamoylamino]phenyl]acetamide is sourced from PubChem (CID 108892060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).