6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one

C19H20N2O4 — CID 127904119

IUPAC6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1cc(C2CC2)[nH]c(=O)c1)N1CCOC(c2cccc(O)c2)C1
InChIInChI=1S/C19H20N2O4/c22-15-3-1-2-13(8-15)17-11-21(6-7-25-17)19(24)14-9-16(12-4-5-12)20-18(23)10-14/h1-3,8-10,12,17,22H,4-7,11H2,(H,20,23)
InChIKeyBYACGNYORIYAFP-UHFFFAOYSA-N
MW340.38 g/mol
LogP2.17
Rot. Bonds3

About 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one

6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one (PubChem CID 127904119) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one
PubChem CID127904119
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC Name6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1cc(C2CC2)[nH]c(=O)c1)N1CCOC(c2cccc(O)c2)C1
InChIInChI=1S/C19H20N2O4/c22-15-3-1-2-13(8-15)17-11-21(6-7-25-17)19(24)14-9-16(12-4-5-12)20-18(23)10-14/h1-3,8-10,12,17,22H,4-7,11H2,(H,20,23)
InChIKeyBYACGNYORIYAFP-UHFFFAOYSA-N
XLogP2.17
TPSA82.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one (CID 127904119) is 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one is O=C(c1cc(C2CC2)[nH]c(=O)c1)N1CCOC(c2cccc(O)c2)C1.
What is the InChIKey of 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
The InChIKey is BYACGNYORIYAFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c22-15-3-1-2-13(8-15)17-11-21(6-7-25-17)19(24)14-9-16(12-4-5-12)20-18(23)10-14/h1-3,8-10,12,17,22H,4-7,11H2,(H,20,23).
What are the key properties of 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one?
6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one has a molecular weight of 340.38 g/mol, XLogP of 2.17, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-4-[2-(3-hydroxyphenyl)morpholine-4-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 127904119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).