5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one

C17H24N2O3 — CID 45250530

IUPAC5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCOC(CC2CCCCC2)C1
InChIInChI=1S/C17H24N2O3/c20-16-7-6-14(11-18-16)17(21)19-8-9-22-15(12-19)10-13-4-2-1-3-5-13/h6-7,11,13,15H,1-5,8-10,12H2,(H,18,20)
InChIKeyYVMNJHJNSOIGHE-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.19
Rot. Bonds3

About 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one

5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one (PubChem CID 45250530) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one
PubChem CID45250530
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1ccc(=O)[nH]c1)N1CCOC(CC2CCCCC2)C1
InChIInChI=1S/C17H24N2O3/c20-16-7-6-14(11-18-16)17(21)19-8-9-22-15(12-19)10-13-4-2-1-3-5-13/h6-7,11,13,15H,1-5,8-10,12H2,(H,18,20)
InChIKeyYVMNJHJNSOIGHE-UHFFFAOYSA-N
XLogP2.19
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one (CID 45250530) is 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one is O=C(c1ccc(=O)[nH]c1)N1CCOC(CC2CCCCC2)C1.
What is the InChIKey of 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
The InChIKey is YVMNJHJNSOIGHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c20-16-7-6-14(11-18-16)17(21)19-8-9-22-15(12-19)10-13-4-2-1-3-5-13/h6-7,11,13,15H,1-5,8-10,12H2,(H,18,20).
What are the key properties of 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one has a molecular weight of 304.39 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(cyclohexylmethyl)morpholine-4-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 45250530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).