methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate

C10H12N2O4 — CID 108895907

IUPACmethyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate
SMILESCOC(=O)CNC(=O)Nc1cccc(O)c1
InChIInChI=1S/C10H12N2O4/c1-16-9(14)6-11-10(15)12-7-3-2-4-8(13)5-7/h2-5,13H,6H2,1H3,(H2,11,12,15)
InChIKeyRSVGLTTUPJHZAD-UHFFFAOYSA-N
MW224.22 g/mol
LogP0.69
Rot. Bonds3

About methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate

methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate (PubChem CID 108895907) has the molecular formula C10H12N2O4 and a molecular weight of 224.22 g/mol. Its IUPAC name is methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate.

Molecular Properties

Compound Namemethyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate
PubChem CID108895907
Molecular FormulaC10H12N2O4
Molecular Weight224.22 g/mol
Exact Mass224.08
IUPAC Namemethyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate
SMILESCOC(=O)CNC(=O)Nc1cccc(O)c1
InChIInChI=1S/C10H12N2O4/c1-16-9(14)6-11-10(15)12-7-3-2-4-8(13)5-7/h2-5,13H,6H2,1H3,(H2,11,12,15)
InChIKeyRSVGLTTUPJHZAD-UHFFFAOYSA-N
XLogP0.69
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 50.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-[(3-bromophenyl)carbamoylamino]acetate
CID 108870222
1-(3-hydroxyphenyl)-3-[6-[(3-hydroxyphenyl)carbamoylamino]hexyl]urea
CID 71353515
1-(3-hydroxyphenyl)-3-(3-oxobutyl)urea
CID 108894947
methyl 2-[(3-hydroxybenzoyl)amino]acetate
CID 578046
methyl 2-[[2,6-di(propan-2-yl)phenyl]carbamoylamino]acetate
CID 162651561
N-[4-[(3-hydroxyphenyl)carbamoylamino]phenyl]acetamide
CID 108895676
methyl 2-[(4-acetylphenyl)carbamoylamino]acetate
CID 39733012
1-amino-3-(3-hydroxyphenyl)urea
CID 23273555
1-(3-hydroxyphenyl)-3-(2-phenylethyl)urea
CID 108888024
2-[4-[(2-methoxy-2-oxoethyl)carbamoylamino]phenyl]-2-methylpropanoic acid
CID 80549262
2-fluoro-4-[(2-methoxy-2-oxoethyl)carbamoylamino]benzoic acid
CID 114002321
tert-butyl 2-[(3-chlorophenyl)carbamoylamino]acetate
CID 140974829

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate?
The IUPAC name of methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate (CID 108895907) is methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate.
What is the SMILES notation for methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate?
The canonical SMILES for methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate is COC(=O)CNC(=O)Nc1cccc(O)c1.
What is the InChIKey of methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate?
The InChIKey is RSVGLTTUPJHZAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O4/c1-16-9(14)6-11-10(15)12-7-3-2-4-8(13)5-7/h2-5,13H,6H2,1H3,(H2,11,12,15).
What are the key properties of methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate?
methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate has a molecular weight of 224.22 g/mol, XLogP of 0.69, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(3-hydroxyphenyl)carbamoylamino]acetate is sourced from PubChem (CID 108895907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).