ethyl N-(2-aminoacetyl)-N-phenylcarbamate

C11H14N2O3 — CID 174322881

IUPACethyl N-(2-aminoacetyl)-N-phenylcarbamate
SMILESCCOC(=O)N(C(=O)CN)c1ccccc1
InChIInChI=1S/C11H14N2O3/c1-2-16-11(15)13(10(14)8-12)9-6-4-3-5-7-9/h3-7H,2,8,12H2,1H3
InChIKeyDBMWXCBYLDPSNY-UHFFFAOYSA-N
MW222.24 g/mol
LogP1.13
Rot. Bonds3

About ethyl N-(2-aminoacetyl)-N-phenylcarbamate

ethyl N-(2-aminoacetyl)-N-phenylcarbamate (PubChem CID 174322881) has the molecular formula C11H14N2O3 and a molecular weight of 222.24 g/mol. Its IUPAC name is ethyl N-(2-aminoacetyl)-N-phenylcarbamate.

Molecular Properties

Compound Nameethyl N-(2-aminoacetyl)-N-phenylcarbamate
PubChem CID174322881
Molecular FormulaC11H14N2O3
Molecular Weight222.24 g/mol
Exact Mass222.10
IUPAC Nameethyl N-(2-aminoacetyl)-N-phenylcarbamate
SMILESCCOC(=O)N(C(=O)CN)c1ccccc1
InChIInChI=1S/C11H14N2O3/c1-2-16-11(15)13(10(14)8-12)9-6-4-3-5-7-9/h3-7H,2,8,12H2,1H3
InChIKeyDBMWXCBYLDPSNY-UHFFFAOYSA-N
XLogP1.13
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-aminoacetyl)-N-phenylcarbamate?
The IUPAC name of ethyl N-(2-aminoacetyl)-N-phenylcarbamate (CID 174322881) is ethyl N-(2-aminoacetyl)-N-phenylcarbamate.
What is the SMILES notation for ethyl N-(2-aminoacetyl)-N-phenylcarbamate?
The canonical SMILES for ethyl N-(2-aminoacetyl)-N-phenylcarbamate is CCOC(=O)N(C(=O)CN)c1ccccc1.
What is the InChIKey of ethyl N-(2-aminoacetyl)-N-phenylcarbamate?
The InChIKey is DBMWXCBYLDPSNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3/c1-2-16-11(15)13(10(14)8-12)9-6-4-3-5-7-9/h3-7H,2,8,12H2,1H3.
What are the key properties of ethyl N-(2-aminoacetyl)-N-phenylcarbamate?
ethyl N-(2-aminoacetyl)-N-phenylcarbamate has a molecular weight of 222.24 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-aminoacetyl)-N-phenylcarbamate is sourced from PubChem (CID 174322881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).