1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one

C14H20N2O3 — CID 70747151

IUPAC1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one
SMILESCC[C@H]1COCCN1C(=O)c1ccn(CC)c(=O)c1
InChIInChI=1S/C14H20N2O3/c1-3-12-10-19-8-7-16(12)14(18)11-5-6-15(4-2)13(17)9-11/h5-6,9,12H,3-4,7-8,10H2,1-2H3/t12-/m0/s1
InChIKeyZUSRTBGEZKSAAW-LBPRGKRZSA-N
MW264.32 g/mol
LogP1.12
Rot. Bonds3

About 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one

1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one (PubChem CID 70747151) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one.

Molecular Properties

Compound Name1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one
PubChem CID70747151
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one
SMILESCC[C@H]1COCCN1C(=O)c1ccn(CC)c(=O)c1
InChIInChI=1S/C14H20N2O3/c1-3-12-10-19-8-7-16(12)14(18)11-5-6-15(4-2)13(17)9-11/h5-6,9,12H,3-4,7-8,10H2,1-2H3/t12-/m0/s1
InChIKeyZUSRTBGEZKSAAW-LBPRGKRZSA-N
XLogP1.12
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one?
The IUPAC name of 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one (CID 70747151) is 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one.
What is the SMILES notation for 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one?
The canonical SMILES for 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one is CC[C@H]1COCCN1C(=O)c1ccn(CC)c(=O)c1.
What is the InChIKey of 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one?
The InChIKey is ZUSRTBGEZKSAAW-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-12-10-19-8-7-16(12)14(18)11-5-6-15(4-2)13(17)9-11/h5-6,9,12H,3-4,7-8,10H2,1-2H3/t12-/m0/s1.
What are the key properties of 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one?
1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one has a molecular weight of 264.32 g/mol, XLogP of 1.12, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[(3S)-3-ethylmorpholine-4-carbonyl]pyridin-2-one is sourced from PubChem (CID 70747151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).