1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea

C16H24N4O4 — CID 167813849

IUPAC1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea
SMILESCc1cc(NC(=O)NC2(C(=O)N3CCOCC3)CCCCC2)no1
InChIInChI=1S/C16H24N4O4/c1-12-11-13(19-24-12)17-15(22)18-16(5-3-2-4-6-16)14(21)20-7-9-23-10-8-20/h11H,2-10H2,1H3,(H2,17,18,19,22)
InChIKeyWPQKPOSTHHQPPH-UHFFFAOYSA-N
MW336.39 g/mol
LogP1.67
Rot. Bonds3

About 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea

1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea (PubChem CID 167813849) has the molecular formula C16H24N4O4 and a molecular weight of 336.39 g/mol. Its IUPAC name is 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea.

Molecular Properties

Compound Name1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea
PubChem CID167813849
Molecular FormulaC16H24N4O4
Molecular Weight336.39 g/mol
Exact Mass336.18
IUPAC Name1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea
SMILESCc1cc(NC(=O)NC2(C(=O)N3CCOCC3)CCCCC2)no1
InChIInChI=1S/C16H24N4O4/c1-12-11-13(19-24-12)17-15(22)18-16(5-3-2-4-6-16)14(21)20-7-9-23-10-8-20/h11H,2-10H2,1H3,(H2,17,18,19,22)
InChIKeyWPQKPOSTHHQPPH-UHFFFAOYSA-N
XLogP1.67
TPSA96.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea?
The IUPAC name of 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea (CID 167813849) is 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea.
What is the SMILES notation for 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea?
The canonical SMILES for 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea is Cc1cc(NC(=O)NC2(C(=O)N3CCOCC3)CCCCC2)no1.
What is the InChIKey of 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea?
The InChIKey is WPQKPOSTHHQPPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O4/c1-12-11-13(19-24-12)17-15(22)18-16(5-3-2-4-6-16)14(21)20-7-9-23-10-8-20/h11H,2-10H2,1H3,(H2,17,18,19,22).
What are the key properties of 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea?
1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea has a molecular weight of 336.39 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1,2-oxazol-3-yl)-3-[1-(morpholine-4-carbonyl)cyclohexyl]urea is sourced from PubChem (CID 167813849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).