benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate

C14H18N2O4 — CID 3668350

IUPACbenzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate
SMILESO=C(NCC(=O)N1CCOCC1)OCc1ccccc1
InChIInChI=1S/C14H18N2O4/c17-13(16-6-8-19-9-7-16)10-15-14(18)20-11-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,15,18)
InChIKeyGBSPBRGWMGSOAG-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.77
Rot. Bonds4

About benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate

benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate (PubChem CID 3668350) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate.

Molecular Properties

Compound Namebenzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate
PubChem CID3668350
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC Namebenzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate
SMILESO=C(NCC(=O)N1CCOCC1)OCc1ccccc1
InChIInChI=1S/C14H18N2O4/c17-13(16-6-8-19-9-7-16)10-15-14(18)20-11-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,15,18)
InChIKeyGBSPBRGWMGSOAG-UHFFFAOYSA-N
XLogP0.77
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate?
The IUPAC name of benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate (CID 3668350) is benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate.
What is the SMILES notation for benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate?
The canonical SMILES for benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate is O=C(NCC(=O)N1CCOCC1)OCc1ccccc1.
What is the InChIKey of benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate?
The InChIKey is GBSPBRGWMGSOAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c17-13(16-6-8-19-9-7-16)10-15-14(18)20-11-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,15,18).
What are the key properties of benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate?
benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate has a molecular weight of 278.31 g/mol, XLogP of 0.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl N-(2-morpholin-4-yl-2-oxoethyl)carbamate is sourced from PubChem (CID 3668350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).