1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea

C9H17N3O3 — CID 59887644

IUPAC1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea
SMILESCCNC(=O)NCC(=O)N1CCOCC1
InChIInChI=1S/C9H17N3O3/c1-2-10-9(14)11-7-8(13)12-3-5-15-6-4-12/h2-7H2,1H3,(H2,10,11,14)
InChIKeyKVXKCWNEWMVPBD-UHFFFAOYSA-N
MW215.25 g/mol
LogP-0.84
Rot. Bonds3

About 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea

1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea (PubChem CID 59887644) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea.

Molecular Properties

Compound Name1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea
PubChem CID59887644
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Name1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea
SMILESCCNC(=O)NCC(=O)N1CCOCC1
InChIInChI=1S/C9H17N3O3/c1-2-10-9(14)11-7-8(13)12-3-5-15-6-4-12/h2-7H2,1H3,(H2,10,11,14)
InChIKeyKVXKCWNEWMVPBD-UHFFFAOYSA-N
XLogP-0.84
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-0.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea?
The IUPAC name of 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea (CID 59887644) is 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea.
What is the SMILES notation for 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea?
The canonical SMILES for 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea is CCNC(=O)NCC(=O)N1CCOCC1.
What is the InChIKey of 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea?
The InChIKey is KVXKCWNEWMVPBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-2-10-9(14)11-7-8(13)12-3-5-15-6-4-12/h2-7H2,1H3,(H2,10,11,14).
What are the key properties of 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea?
1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea has a molecular weight of 215.25 g/mol, XLogP of -0.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3-(2-morpholin-4-yl-2-oxoethyl)urea is sourced from PubChem (CID 59887644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).