methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate

C14H18N2O4 — CID 66433003

IUPACmethyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate
SMILESCOC(=O)c1ccccc1NC(=O)CC1CNCCO1
InChIInChI=1S/C14H18N2O4/c1-19-14(18)11-4-2-3-5-12(11)16-13(17)8-10-9-15-6-7-20-10/h2-5,10,15H,6-9H2,1H3,(H,16,17)
InChIKeyNZEWINYHRDAYCI-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.79
Rot. Bonds4

About methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate

methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate (PubChem CID 66433003) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate.

Molecular Properties

Compound Namemethyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate
PubChem CID66433003
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Namemethyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate
SMILESCOC(=O)c1ccccc1NC(=O)CC1CNCCO1
InChIInChI=1S/C14H18N2O4/c1-19-14(18)11-4-2-3-5-12(11)16-13(17)8-10-9-15-6-7-20-10/h2-5,10,15H,6-9H2,1H3,(H,16,17)
InChIKeyNZEWINYHRDAYCI-UHFFFAOYSA-N
XLogP0.79
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-fluoro-2-[(2-morpholin-2-ylacetyl)amino]benzoate
CID 66428476
N-(2-methylpropyl)-2-[(2-morpholin-2-ylacetyl)amino]benzamide;hydrochloride
CID 119684646
2-methyl-3-[(2-morpholin-2-ylacetyl)amino]benzoic acid
CID 66434366
N-[2-(dimethylamino)phenyl]-2-morpholin-2-ylacetamide;dihydrochloride
CID 119843667
methyl 4-[(2-morpholin-2-ylacetyl)amino]benzoate;hydrochloride
CID 119671383
N-(2-benzylphenyl)-2-morpholin-2-ylacetamide
CID 119675738
2-morpholin-2-yl-N-phenylacetamide;hydrochloride
CID 119670265
N-(3-chloro-2-methylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119671783
N-[2-(difluoromethylsulfanyl)phenyl]-2-morpholin-2-ylacetamide
CID 66433758
N-[2-(3-methylphenoxy)phenyl]-2-[(2S)-morpholin-2-yl]acetamide
CID 97318590
N-(4,5-dimethoxy-2-methylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119679107
N-(2,6-dimethylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119676388

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate?
The IUPAC name of methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate (CID 66433003) is methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate.
What is the SMILES notation for methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate?
The canonical SMILES for methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate is COC(=O)c1ccccc1NC(=O)CC1CNCCO1.
What is the InChIKey of methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate?
The InChIKey is NZEWINYHRDAYCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-19-14(18)11-4-2-3-5-12(11)16-13(17)8-10-9-15-6-7-20-10/h2-5,10,15H,6-9H2,1H3,(H,16,17).
What are the key properties of methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate?
methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate has a molecular weight of 278.31 g/mol, XLogP of 0.79, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(2-morpholin-2-ylacetyl)amino]benzoate is sourced from PubChem (CID 66433003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).