2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid

C16H16N2O4 — CID 6465663

IUPAC2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid
SMILESCOc1ccc(NC(=O)Nc2ccc(CC(=O)O)cc2)cc1
InChIInChI=1S/C16H16N2O4/c1-22-14-8-6-13(7-9-14)18-16(21)17-12-4-2-11(3-5-12)10-15(19)20/h2-9H,10H2,1H3,(H,19,20)(H2,17,18,21)
InChIKeyYUDOGWMGLHTNJW-UHFFFAOYSA-N
MW300.31 g/mol
LogP2.97
Rot. Bonds5

About 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid

2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid (PubChem CID 6465663) has the molecular formula C16H16N2O4 and a molecular weight of 300.31 g/mol. Its IUPAC name is 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid.

Molecular Properties

Compound Name2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid
PubChem CID6465663
Molecular FormulaC16H16N2O4
Molecular Weight300.31 g/mol
Exact Mass300.11
IUPAC Name2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid
SMILESCOc1ccc(NC(=O)Nc2ccc(CC(=O)O)cc2)cc1
InChIInChI=1S/C16H16N2O4/c1-22-14-8-6-13(7-9-14)18-16(21)17-12-4-2-11(3-5-12)10-15(19)20/h2-9H,10H2,1H3,(H,19,20)(H2,17,18,21)
InChIKeyYUDOGWMGLHTNJW-UHFFFAOYSA-N
XLogP2.97
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.31
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid 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

Vidofludimus
CID 9820008
4-[[(4-Methoxyanilino)-oxomethyl]amino]benzoic acid methyl ester
CID 970268
N-(4-methoxyphenyl)-2-phenylacetamide
CID 531989
4'-Methoxyphthalanilic acid
CID 792715
(1R,2R)-2-{[4-(4-{[(4-methoxyphenyl)carbamoyl]amino}phenyl)phenyl]carbonyl}cyclopentane-1-carboxylic acid
CID 24768268
Ethyl 3-[(4-sulfamoyloxyphenyl)carbamoylamino]benzoate
CID 70690387
Phenyl ({[4-(methoxycarbonyl)phenyl]amino}carbonylamino)formate
CID 728299
2'-[(4-Methoxyphenyl)carbamoyl]biphenyl-2-carboxylic acid
CID 951257
N-[(4-methoxyphenyl)carbamoyl]benzamide
CID 977500
3-(3-(4-(Phenoxymethyl)phenyl)ureido)benzoic acid
CID 2812103
N-(4-Ethoxy-phenyl)-3-(4-methyl-benzyl)-succinamic acid
CID 3109040
2-{[4-(Benzyloxy)phenyl]carbamoyl}cyclohexanecarboxylic acid
CID 4621430

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid?
The IUPAC name of 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid (CID 6465663) is 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid.
What is the SMILES notation for 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid?
The canonical SMILES for 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid is COc1ccc(NC(=O)Nc2ccc(CC(=O)O)cc2)cc1.
What is the InChIKey of 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid?
The InChIKey is YUDOGWMGLHTNJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O4/c1-22-14-8-6-13(7-9-14)18-16(21)17-12-4-2-11(3-5-12)10-15(19)20/h2-9H,10H2,1H3,(H,19,20)(H2,17,18,21).
What are the key properties of 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid?
2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid has a molecular weight of 300.31 g/mol, XLogP of 2.97, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4-methoxyphenyl)carbamoylamino]phenyl]acetic acid is sourced from PubChem (CID 6465663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).