1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone

C18H18N2O3 — CID 42845751

IUPAC1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone
SMILESCC(=O)c1ccc(-c2cncc(C(=O)N3CCOCC3)c2)cc1
InChIInChI=1S/C18H18N2O3/c1-13(21)14-2-4-15(5-3-14)16-10-17(12-19-11-16)18(22)20-6-8-23-9-7-20/h2-5,10-12H,6-9H2,1H3
InChIKeyGYBZJZMJUVOYJL-UHFFFAOYSA-N
MW310.35 g/mol
LogP2.42
Rot. Bonds3

About 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone

1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone (PubChem CID 42845751) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone.

Molecular Properties

Compound Name1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone
PubChem CID42845751
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone
SMILESCC(=O)c1ccc(-c2cncc(C(=O)N3CCOCC3)c2)cc1
InChIInChI=1S/C18H18N2O3/c1-13(21)14-2-4-15(5-3-14)16-10-17(12-19-11-16)18(22)20-6-8-23-9-7-20/h2-5,10-12H,6-9H2,1H3
InChIKeyGYBZJZMJUVOYJL-UHFFFAOYSA-N
XLogP2.42
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-[5-(2-hydroxypropan-2-yl)-3-pyridinyl]phenyl]-morpholin-4-ylmethanone
CID 91832951
[5-(4-chlorophenyl)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 42845797
[5-(4-chlorophenyl)-3-pyridinyl]-[(2R)-2-methylmorpholin-4-yl]methanone
CID 136582281
(5-ethenyl-3-pyridinyl)-morpholin-4-ylmethanone
CID 155919849
morpholin-4-yl-(5-propan-2-yloxy-3-pyridinyl)methanone
CID 53013984
N,N-diethyl-5-(morpholine-4-carbonyl)pyridine-3-carboxamide
CID 109103773
[2-(5-methyl-3-pyridinyl)-4-pyridinyl]-morpholin-4-ylmethanone
CID 74233897
methyl 4-[[5-(morpholine-4-carbonyl)-3-pyridinyl]amino]benzoate
CID 109228503
[4-(4-methoxyphenyl)phenyl]-morpholin-4-ylmethanone
CID 3530238
morpholin-4-yl(pyridazin-4-yl)methanone
CID 115736040
N,N-dimethyl-4-(5-phenylpyridine-3-carbonyl)piperazine-1-carboxamide
CID 71920561
[4-(3-methylphenyl)piperazin-1-yl]-[5-(morpholine-4-carbonyl)-3-pyridinyl]methanone
CID 109103768

Frequently Asked Questions

What is the IUPAC name of 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone?
The IUPAC name of 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone (CID 42845751) is 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone.
What is the SMILES notation for 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone?
The canonical SMILES for 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone is CC(=O)c1ccc(-c2cncc(C(=O)N3CCOCC3)c2)cc1.
What is the InChIKey of 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone?
The InChIKey is GYBZJZMJUVOYJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-13(21)14-2-4-15(5-3-14)16-10-17(12-19-11-16)18(22)20-6-8-23-9-7-20/h2-5,10-12H,6-9H2,1H3.
What are the key properties of 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone?
1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone has a molecular weight of 310.35 g/mol, XLogP of 2.42, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[5-(morpholine-4-carbonyl)-3-pyridinyl]phenyl]ethanone is sourced from PubChem (CID 42845751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).