1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea

C11H22N4O2 — CID 117235873

IUPAC1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea
SMILESO=C(NCCN1CCOCC1)NCC1CNC1
InChIInChI=1S/C11H22N4O2/c16-11(14-9-10-7-12-8-10)13-1-2-15-3-5-17-6-4-15/h10,12H,1-9H2,(H2,13,14,16)
InChIKeyXGFBKJDTIVNLHZ-UHFFFAOYSA-N
MW242.32 g/mol
LogP-1.16
Rot. Bonds5

About 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea

1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea (PubChem CID 117235873) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea.

Molecular Properties

Compound Name1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea
PubChem CID117235873
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea
SMILESO=C(NCCN1CCOCC1)NCC1CNC1
InChIInChI=1S/C11H22N4O2/c16-11(14-9-10-7-12-8-10)13-1-2-15-3-5-17-6-4-15/h10,12H,1-9H2,(H2,13,14,16)
InChIKeyXGFBKJDTIVNLHZ-UHFFFAOYSA-N
XLogP-1.16
TPSA65.63 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-1.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(azetidin-3-ylmethyl)-3-(2-piperidin-1-ylethyl)urea
CID 117235872
1-(2-morpholin-4-ylethyl)-3-propylurea
CID 4583080
1-(2-piperidin-1-ylethyl)-3-(piperidin-3-ylmethyl)urea
CID 117235876
1-(2-morpholin-4-ylethyl)-3-pentylurea
CID 108988288
1-cycloheptyl-3-(2-morpholin-4-ylethyl)urea
CID 47163906
2-[2-(2-morpholin-4-ylethylcarbamoylamino)ethoxy]acetic acid
CID 79463716
1-(2-methoxyethoxymethyl)-3-(2-morpholin-4-ylethyl)urea
CID 108894367
1-(2-morpholin-4-ylethyl)-3-(3-triethoxysilylpropyl)urea
CID 59782824
N-(2-morpholin-4-ylethyl)-5-oxopiperazine-2-carboxamide
CID 107433529
1-(2-morpholin-4-ylethylcarbamoyl)cyclopropane-1-carboxylic acid
CID 62095713
2-[(2-morpholin-4-ylethylcarbamoylamino)methyl]butanoic acid
CID 65218493
N-(3-morpholin-4-ylpropyl)-N'-(2-piperazin-1-ylethyl)oxamide
CID 108517732

Frequently Asked Questions

What is the IUPAC name of 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea?
The IUPAC name of 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea (CID 117235873) is 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea.
What is the SMILES notation for 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea?
The canonical SMILES for 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea is O=C(NCCN1CCOCC1)NCC1CNC1.
What is the InChIKey of 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea?
The InChIKey is XGFBKJDTIVNLHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2/c16-11(14-9-10-7-12-8-10)13-1-2-15-3-5-17-6-4-15/h10,12H,1-9H2,(H2,13,14,16).
What are the key properties of 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea?
1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea has a molecular weight of 242.32 g/mol, XLogP of -1.16, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(azetidin-3-ylmethyl)-3-(2-morpholin-4-ylethyl)urea is sourced from PubChem (CID 117235873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).