1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea

C11H21N3O3 — CID 113229862

IUPAC1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea
SMILESCCN(C)C(=O)NCCC(=O)N1CCOCC1
InChIInChI=1S/C11H21N3O3/c1-3-13(2)11(16)12-5-4-10(15)14-6-8-17-9-7-14/h3-9H2,1-2H3,(H,12,16)
InChIKeyHGVDYDSCKQIXQF-UHFFFAOYSA-N
MW243.31 g/mol
LogP-0.10
Rot. Bonds4

About 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea

1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea (PubChem CID 113229862) has the molecular formula C11H21N3O3 and a molecular weight of 243.31 g/mol. Its IUPAC name is 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea.

Molecular Properties

Compound Name1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea
PubChem CID113229862
Molecular FormulaC11H21N3O3
Molecular Weight243.31 g/mol
Exact Mass243.16
IUPAC Name1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea
SMILESCCN(C)C(=O)NCCC(=O)N1CCOCC1
InChIInChI=1S/C11H21N3O3/c1-3-13(2)11(16)12-5-4-10(15)14-6-8-17-9-7-14/h3-9H2,1-2H3,(H,12,16)
InChIKeyHGVDYDSCKQIXQF-UHFFFAOYSA-N
XLogP-0.10
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyanoethyl)-3-morpholinopropanamide
CID 657480
1-Butyl-3-(2-morpholinoethyl)urea
CID 1632256
N-(3-ethoxypropyl)morpholine-4-carboxamide
CID 2180707
Ethyl 2-(4-morpholin-4-yl-6-oxo-1,3-diazinan-2-yl)acetate
CID 75306245
N-methyl-3-morpholin-4-ylpropanamide;hydrochloride
CID 45264777
2-methyl-N-(3-morpholin-4-ylpropyl)propanamide
CID 2234916
2,2-dimethyl-N-[3-(morpholin-4-yl)propyl]propanamide
CID 3107364
N-(3-methoxypropyl)morpholine-4-carboxamide
CID 3136313
1-Tert-butyl-3-(3-morpholin-4-ylpropyl)urea
CID 304916
N-(pentan-3-yl)morpholine-4-carboxamide
CID 787327
N-(1-methoxypropan-2-yl)morpholine-4-carboxamide
CID 2904482
N-(2-methylpropyl)morpholine-4-carboxamide
CID 3410823

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea?
The IUPAC name of 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea (CID 113229862) is 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea.
What is the SMILES notation for 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea?
The canonical SMILES for 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea is CCN(C)C(=O)NCCC(=O)N1CCOCC1.
What is the InChIKey of 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea?
The InChIKey is HGVDYDSCKQIXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O3/c1-3-13(2)11(16)12-5-4-10(15)14-6-8-17-9-7-14/h3-9H2,1-2H3,(H,12,16).
What are the key properties of 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea?
1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea has a molecular weight of 243.31 g/mol, XLogP of -0.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-methyl-3-(3-morpholin-4-yl-3-oxopropyl)urea is sourced from PubChem (CID 113229862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).