1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea

C17H30N4O3 — CID 67489629

IUPAC1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea
SMILESNC(=O)N(C1CCCCC1)C1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C17H30N4O3/c18-16(22)21(14-4-2-1-3-5-14)15-6-8-19(9-7-15)17(23)20-10-12-24-13-11-20/h14-15H,1-13H2,(H2,18,22)
InChIKeyMWZUDWCPUVPONF-UHFFFAOYSA-N
MW338.45 g/mol
LogP1.62
Rot. Bonds2

About 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea

1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea (PubChem CID 67489629) has the molecular formula C17H30N4O3 and a molecular weight of 338.45 g/mol. Its IUPAC name is 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea.

Molecular Properties

Compound Name1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea
PubChem CID67489629
Molecular FormulaC17H30N4O3
Molecular Weight338.45 g/mol
Exact Mass338.23
IUPAC Name1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea
SMILESNC(=O)N(C1CCCCC1)C1CCN(C(=O)N2CCOCC2)CC1
InChIInChI=1S/C17H30N4O3/c18-16(22)21(14-4-2-1-3-5-14)15-6-8-19(9-7-15)17(23)20-10-12-24-13-11-20/h14-15H,1-13H2,(H2,18,22)
InChIKeyMWZUDWCPUVPONF-UHFFFAOYSA-N
XLogP1.62
TPSA79.11 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea?
The IUPAC name of 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea (CID 67489629) is 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea.
What is the SMILES notation for 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea?
The canonical SMILES for 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea is NC(=O)N(C1CCCCC1)C1CCN(C(=O)N2CCOCC2)CC1.
What is the InChIKey of 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea?
The InChIKey is MWZUDWCPUVPONF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4O3/c18-16(22)21(14-4-2-1-3-5-14)15-6-8-19(9-7-15)17(23)20-10-12-24-13-11-20/h14-15H,1-13H2,(H2,18,22).
What are the key properties of 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea?
1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea has a molecular weight of 338.45 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-1-[1-(morpholine-4-carbonyl)piperidin-4-yl]urea is sourced from PubChem (CID 67489629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).