tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate

C14H27N3O4 — CID 19753841

IUPACtert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate
SMILESCN(CCN(C)C(=O)N1CCOCC1)C(=O)OC(C)(C)C
InChIInChI=1S/C14H27N3O4/c1-14(2,3)21-13(19)16(5)7-6-15(4)12(18)17-8-10-20-11-9-17/h6-11H2,1-5H3
InChIKeyKPRBFEGAWKJGRW-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.24
Rot. Bonds3

About tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate

tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate (PubChem CID 19753841) has the molecular formula C14H27N3O4 and a molecular weight of 301.39 g/mol. Its IUPAC name is tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate
PubChem CID19753841
Molecular FormulaC14H27N3O4
Molecular Weight301.39 g/mol
Exact Mass301.20
IUPAC Nametert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate
SMILESCN(CCN(C)C(=O)N1CCOCC1)C(=O)OC(C)(C)C
InChIInChI=1S/C14H27N3O4/c1-14(2,3)21-13(19)16(5)7-6-15(4)12(18)17-8-10-20-11-9-17/h6-11H2,1-5H3
InChIKeyKPRBFEGAWKJGRW-UHFFFAOYSA-N
XLogP1.24
TPSA62.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate?
The IUPAC name of tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate (CID 19753841) is tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate.
What is the SMILES notation for tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate?
The canonical SMILES for tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate is CN(CCN(C)C(=O)N1CCOCC1)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate?
The InChIKey is KPRBFEGAWKJGRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O4/c1-14(2,3)21-13(19)16(5)7-6-15(4)12(18)17-8-10-20-11-9-17/h6-11H2,1-5H3.
What are the key properties of tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate?
tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate has a molecular weight of 301.39 g/mol, XLogP of 1.24, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-methyl-N-[2-[methyl(morpholine-4-carbonyl)amino]ethyl]carbamate is sourced from PubChem (CID 19753841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).