methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate

C14H18N2O5 — CID 2923381

IUPACmethyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate
SMILESCOC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H18N2O5/c1-19-14(18)15-11-2-4-12(5-3-11)21-10-13(17)16-6-8-20-9-7-16/h2-5H,6-10H2,1H3,(H,15,18)
InChIKeySAWAPSYINMPERO-UHFFFAOYSA-N
MW294.31 g/mol
LogP1.10
Rot. Bonds4

About methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate

methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate (PubChem CID 2923381) has the molecular formula C14H18N2O5 and a molecular weight of 294.31 g/mol. Its IUPAC name is methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate.

Molecular Properties

Compound Namemethyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate
PubChem CID2923381
Molecular FormulaC14H18N2O5
Molecular Weight294.31 g/mol
Exact Mass294.12
IUPAC Namemethyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate
SMILESCOC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H18N2O5/c1-19-14(18)15-11-2-4-12(5-3-11)21-10-13(17)16-6-8-20-9-7-16/h2-5H,6-10H2,1H3,(H,15,18)
InChIKeySAWAPSYINMPERO-UHFFFAOYSA-N
XLogP1.10
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate?
The IUPAC name of methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate (CID 2923381) is methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate.
What is the SMILES notation for methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate?
The canonical SMILES for methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate is COC(=O)Nc1ccc(OCC(=O)N2CCOCC2)cc1.
What is the InChIKey of methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate?
The InChIKey is SAWAPSYINMPERO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O5/c1-19-14(18)15-11-2-4-12(5-3-11)21-10-13(17)16-6-8-20-9-7-16/h2-5H,6-10H2,1H3,(H,15,18).
What are the key properties of methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate?
methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate has a molecular weight of 294.31 g/mol, XLogP of 1.10, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[4-(2-morpholin-4-yl-2-oxoethoxy)phenyl]carbamate is sourced from PubChem (CID 2923381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).