tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate

C13H24N2O4 — CID 19753961

IUPACtert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate
SMILESCC(C(=O)N1CCOCC1)N(C)C(=O)OC(C)(C)C
InChIInChI=1S/C13H24N2O4/c1-10(11(16)15-6-8-18-9-7-15)14(5)12(17)19-13(2,3)4/h10H,6-9H2,1-5H3
InChIKeySZSKVZLVXAJGJG-UHFFFAOYSA-N
MW272.34 g/mol
LogP1.10
Rot. Bonds2

About tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate

tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate (PubChem CID 19753961) has the molecular formula C13H24N2O4 and a molecular weight of 272.34 g/mol. Its IUPAC name is tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate
PubChem CID19753961
Molecular FormulaC13H24N2O4
Molecular Weight272.34 g/mol
Exact Mass272.17
IUPAC Nametert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate
SMILESCC(C(=O)N1CCOCC1)N(C)C(=O)OC(C)(C)C
InChIInChI=1S/C13H24N2O4/c1-10(11(16)15-6-8-18-9-7-15)14(5)12(17)19-13(2,3)4/h10H,6-9H2,1-5H3
InChIKeySZSKVZLVXAJGJG-UHFFFAOYSA-N
XLogP1.10
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 51.10
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-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate?
The IUPAC name of tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate (CID 19753961) is tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate.
What is the SMILES notation for tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate?
The canonical SMILES for tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate is CC(C(=O)N1CCOCC1)N(C)C(=O)OC(C)(C)C.
What is the InChIKey of tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate?
The InChIKey is SZSKVZLVXAJGJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O4/c1-10(11(16)15-6-8-18-9-7-15)14(5)12(17)19-13(2,3)4/h10H,6-9H2,1-5H3.
What are the key properties of tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate?
tert-butyl N-methyl-N-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate has a molecular weight of 272.34 g/mol, XLogP of 1.10, 2 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-(1-morpholin-4-yl-1-oxopropan-2-yl)carbamate is sourced from PubChem (CID 19753961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).