1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea

C18H32N4O3 — CID 645711

IUPAC1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea
SMILESO=C(NC1CCCCC1)NC1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C18H32N4O3/c23-17(22-10-12-25-13-11-22)14-21-8-6-16(7-9-21)20-18(24)19-15-4-2-1-3-5-15/h15-16H,1-14H2,(H2,19,20,24)
InChIKeyKDCOEJGYOPRSRC-UHFFFAOYSA-N
MW352.48 g/mol
LogP0.94
Rot. Bonds4

About 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea

1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea (PubChem CID 645711) has the molecular formula C18H32N4O3 and a molecular weight of 352.48 g/mol. Its IUPAC name is 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea.

Molecular Properties

Compound Name1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea
PubChem CID645711
Molecular FormulaC18H32N4O3
Molecular Weight352.48 g/mol
Exact Mass352.25
IUPAC Name1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea
SMILESO=C(NC1CCCCC1)NC1CCN(CC(=O)N2CCOCC2)CC1
InChIInChI=1S/C18H32N4O3/c23-17(22-10-12-25-13-11-22)14-21-8-6-16(7-9-21)20-18(24)19-15-4-2-1-3-5-15/h15-16H,1-14H2,(H2,19,20,24)
InChIKeyKDCOEJGYOPRSRC-UHFFFAOYSA-N
XLogP0.94
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea?
The IUPAC name of 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea (CID 645711) is 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea.
What is the SMILES notation for 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea?
The canonical SMILES for 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea is O=C(NC1CCCCC1)NC1CCN(CC(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea?
The InChIKey is KDCOEJGYOPRSRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O3/c23-17(22-10-12-25-13-11-22)14-21-8-6-16(7-9-21)20-18(24)19-15-4-2-1-3-5-15/h15-16H,1-14H2,(H2,19,20,24).
What are the key properties of 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea?
1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea has a molecular weight of 352.48 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-[1-(2-morpholin-4-yl-2-oxoethyl)piperidin-4-yl]urea is sourced from PubChem (CID 645711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).