[5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone

C18H20ClN3O2 — CID 109184630

IUPAC[5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(NCCc2cccc(Cl)c2)cn1)N1CCOCC1
InChIInChI=1S/C18H20ClN3O2/c19-15-3-1-2-14(12-15)6-7-20-16-4-5-17(21-13-16)18(23)22-8-10-24-11-9-22/h1-5,12-13,20H,6-11H2
InChIKeyRZFXFQZBAXKZFU-UHFFFAOYSA-N
MW345.83 g/mol
LogP2.86
Rot. Bonds5

About [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone

[5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone (PubChem CID 109184630) has the molecular formula C18H20ClN3O2 and a molecular weight of 345.83 g/mol. Its IUPAC name is [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone
PubChem CID109184630
Molecular FormulaC18H20ClN3O2
Molecular Weight345.83 g/mol
Exact Mass345.12
IUPAC Name[5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(NCCc2cccc(Cl)c2)cn1)N1CCOCC1
InChIInChI=1S/C18H20ClN3O2/c19-15-3-1-2-14(12-15)6-7-20-16-4-5-17(21-13-16)18(23)22-8-10-24-11-9-22/h1-5,12-13,20H,6-11H2
InChIKeyRZFXFQZBAXKZFU-UHFFFAOYSA-N
XLogP2.86
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.83
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

morpholin-4-yl-[5-(2-phenylethylamino)-2-pyridinyl]methanone
CID 109184585
[5-(benzylamino)-2-pyridinyl]-morpholin-4-ylmethanone
CID 109184568
4-[2-[[6-(morpholine-4-carbonyl)-3-pyridinyl]amino]ethyl]benzenesulfonamide
CID 109184599
5-[2-(3-chlorophenyl)ethylamino]-N-cyclohexylpyridine-2-carboxamide
CID 109182977
[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109181814
N-[2-(3-chlorophenyl)ethyl]-5-(morpholine-4-carbonyl)pyridine-3-carboxamide
CID 109103786
[5-(3-chloro-4-methylanilino)-2-pyridinyl]-morpholin-4-ylmethanone
CID 109184666
[5-(3-fluoroanilino)-2-pyridinyl]-morpholin-4-ylmethanone
CID 109184706
[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109181785
[6-[2-(3-chlorophenyl)ethylamino]pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 109341697
[5-(2-morpholin-4-ylethylamino)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109182540
5-[2-(3-chlorophenyl)ethylamino]-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 109189383

Frequently Asked Questions

What is the IUPAC name of [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone?
The IUPAC name of [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone (CID 109184630) is [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone?
The canonical SMILES for [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone is O=C(c1ccc(NCCc2cccc(Cl)c2)cn1)N1CCOCC1.
What is the InChIKey of [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone?
The InChIKey is RZFXFQZBAXKZFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClN3O2/c19-15-3-1-2-14(12-15)6-7-20-16-4-5-17(21-13-16)18(23)22-8-10-24-11-9-22/h1-5,12-13,20H,6-11H2.
What are the key properties of [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone?
[5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone has a molecular weight of 345.83 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[2-(3-chlorophenyl)ethylamino]-2-pyridinyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 109184630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).