methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate

C13H17NO5 — CID 43623509

IUPACmethyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate
SMILESCOCc1ccccc1C(=O)NC(CO)C(=O)OC
InChIInChI=1S/C13H17NO5/c1-18-8-9-5-3-4-6-10(9)12(16)14-11(7-15)13(17)19-2/h3-6,11,15H,7-8H2,1-2H3,(H,14,16)
InChIKeyWTQXPTAWAHPCRP-UHFFFAOYSA-N
MW267.28 g/mol
LogP0.10
Rot. Bonds6

About methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate

methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate (PubChem CID 43623509) has the molecular formula C13H17NO5 and a molecular weight of 267.28 g/mol. Its IUPAC name is methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate.

Molecular Properties

Compound Namemethyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate
PubChem CID43623509
Molecular FormulaC13H17NO5
Molecular Weight267.28 g/mol
Exact Mass267.11
IUPAC Namemethyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate
SMILESCOCc1ccccc1C(=O)NC(CO)C(=O)OC
InChIInChI=1S/C13H17NO5/c1-18-8-9-5-3-4-6-10(9)12(16)14-11(7-15)13(17)19-2/h3-6,11,15H,7-8H2,1-2H3,(H,14,16)
InChIKeyWTQXPTAWAHPCRP-UHFFFAOYSA-N
XLogP0.10
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.28
LogP ≤ 50.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate 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

4-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]butanoic acid
CID 61243092
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-(methoxymethyl)benzamide
CID 79247451
N-(2-hydroxy-1-phenylethyl)-2-(methoxymethyl)benzamide
CID 63182538
2-(methoxymethyl)-N-methylbenzamide
CID 60753373
N,2-bis(methoxymethyl)benzamide
CID 91153220
methyl 2-[(2-chloro-3-fluorobenzoyl)amino]-3-hydroxypropanoate
CID 81462130
methyl 3-hydroxy-2-[(2-methoxypyridine-3-carbonyl)amino]propanoate
CID 43423436
2-[[2-(aminomethyl)benzoyl]amino]-3-hydroxypropanoic acid
CID 82547100
methyl (2S)-3-hydroxy-2-(1H-indole-4-carbonylamino)propanoate
CID 152504979
N-(5-hydroxy-4-methylpentyl)-2-(methoxymethyl)benzamide
CID 103862006
methyl 3-hydroxy-2-(quinoline-5-carbonylamino)propanoate
CID 43422482
methyl (2S)-3-hydroxy-2-(phenylmethoxycarbonylamino)propanoate
CID 6999535

Frequently Asked Questions

What is the IUPAC name of methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate?
The IUPAC name of methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate (CID 43623509) is methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate.
What is the SMILES notation for methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate?
The canonical SMILES for methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate is COCc1ccccc1C(=O)NC(CO)C(=O)OC.
What is the InChIKey of methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate?
The InChIKey is WTQXPTAWAHPCRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO5/c1-18-8-9-5-3-4-6-10(9)12(16)14-11(7-15)13(17)19-2/h3-6,11,15H,7-8H2,1-2H3,(H,14,16).
What are the key properties of methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate?
methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate has a molecular weight of 267.28 g/mol, XLogP of 0.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 3-hydroxy-2-[[2-(methoxymethyl)benzoyl]amino]propanoate is sourced from PubChem (CID 43623509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).