ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate

C14H20N2O4 — CID 78917130

IUPACethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate
SMILESCCOC(=O)COc1cccc(NC(=O)N(C)CC)c1
InChIInChI=1S/C14H20N2O4/c1-4-16(3)14(18)15-11-7-6-8-12(9-11)20-10-13(17)19-5-2/h6-9H,4-5,10H2,1-3H3,(H,15,18)
InChIKeyXRZXCEYSFYDBQA-UHFFFAOYSA-N
MW280.32 g/mol
LogP2.11
Rot. Bonds6

About ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate

ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate (PubChem CID 78917130) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate.

Molecular Properties

Compound Nameethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate
PubChem CID78917130
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC Nameethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate
SMILESCCOC(=O)COc1cccc(NC(=O)N(C)CC)c1
InChIInChI=1S/C14H20N2O4/c1-4-16(3)14(18)15-11-7-6-8-12(9-11)20-10-13(17)19-5-2/h6-9H,4-5,10H2,1-3H3,(H,15,18)
InChIKeyXRZXCEYSFYDBQA-UHFFFAOYSA-N
XLogP2.11
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetic acid
CID 61194487
methyl 2-[3-(diethylcarbamoylamino)phenoxy]acetate
CID 112728907
ethyl 2-[3-(but-2-ynoylamino)phenoxy]acetate
CID 107991028
ethyl 2-[3-(tert-butylcarbamoylamino)phenoxy]acetate
CID 60970804
ethyl 2-[methyl-[(3-methylphenyl)carbamoyl]amino]acetate
CID 47406124
3-(3-ethoxyphenyl)-1-(2-hydroxyethyl)-1-methylurea
CID 111431448
ethyl 2-[3-(methanesulfonamido)phenoxy]acetate
CID 60749083
ethyl 2-[3-[(2-fluorobenzoyl)amino]phenoxy]acetate
CID 39269783
ethyl 2-[3-[(2-naphthalen-1-ylacetyl)amino]phenoxy]acetate
CID 39269822
ethyl 2-[4-(dimethylcarbamoylamino)phenoxy]acetate
CID 23823192
ethyl 2-[3-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]phenoxy]acetate
CID 39269639
ethyl 2-[3-(methylaminomethyl)phenoxy]acetate
CID 60882222

Frequently Asked Questions

What is the IUPAC name of ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate?
The IUPAC name of ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate (CID 78917130) is ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate.
What is the SMILES notation for ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate?
The canonical SMILES for ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate is CCOC(=O)COc1cccc(NC(=O)N(C)CC)c1.
What is the InChIKey of ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate?
The InChIKey is XRZXCEYSFYDBQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-4-16(3)14(18)15-11-7-6-8-12(9-11)20-10-13(17)19-5-2/h6-9H,4-5,10H2,1-3H3,(H,15,18).
What are the key properties of ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate?
ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate has a molecular weight of 280.32 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[3-[[ethyl(methyl)carbamoyl]amino]phenoxy]acetate is sourced from PubChem (CID 78917130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).