2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

C20H25N5O2 — CID 72928474

IUPAC2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
SMILESO=C(C(c1cccnc1)N1CCOCC1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C20H25N5O2/c26-20(25-10-8-23(9-11-25)18-5-1-2-7-22-18)19(17-4-3-6-21-16-17)24-12-14-27-15-13-24/h1-7,16,19H,8-15H2
InChIKeyXSBOYSKFWZXFBT-UHFFFAOYSA-N
MW367.45 g/mol
LogP1.20
Rot. Bonds4

About 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone (PubChem CID 72928474) has the molecular formula C20H25N5O2 and a molecular weight of 367.45 g/mol. Its IUPAC name is 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
PubChem CID72928474
Molecular FormulaC20H25N5O2
Molecular Weight367.45 g/mol
Exact Mass367.20
IUPAC Name2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
SMILESO=C(C(c1cccnc1)N1CCOCC1)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C20H25N5O2/c26-20(25-10-8-23(9-11-25)18-5-1-2-7-22-18)19(17-4-3-6-21-16-17)24-12-14-27-15-13-24/h1-7,16,19H,8-15H2
InChIKeyXSBOYSKFWZXFBT-UHFFFAOYSA-N
XLogP1.20
TPSA61.80 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone with MolForge

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Related Compounds

N-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylethyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 126447706
(2S)-2-morpholin-4-yl-1-(1,4-oxazepan-4-yl)-2-pyridin-3-ylethanone
CID 97203647
(2R)-2-morpholin-4-yl-1-(1,4-oxazepan-4-yl)-2-pyridin-3-ylethanone
CID 97203648
2-morpholin-4-yl-2-pyridin-3-yl-1-thiomorpholin-4-ylethanone
CID 74230397
2-(dimethylamino)-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 110753947
2-phenyl-1-piperidin-1-yl-2-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 78738418
3-[1-[(2R)-2-morpholin-4-yl-2-pyridin-3-ylacetyl]piperidin-4-yl]-1,3-oxazolidin-2-one
CID 97276057
1,2-dimorpholin-4-yl-2-phenylethanone
CID 657415
[2-(morpholine-4-carbonyl)cyclopropyl]-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 109133323
1,2-dimorpholin-4-yl-2-phenylethanone;hydrochloride
CID 6603248
2-chloro-2-phenyl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone
CID 3509836
1-(2-morpholin-4-yl-2-oxo-1-pyridin-3-ylethyl)pyrrolidin-2-one
CID 71083509

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone?
The IUPAC name of 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone (CID 72928474) is 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone is O=C(C(c1cccnc1)N1CCOCC1)N1CCN(c2ccccn2)CC1.
What is the InChIKey of 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone?
The InChIKey is XSBOYSKFWZXFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O2/c26-20(25-10-8-23(9-11-25)18-5-1-2-7-22-18)19(17-4-3-6-21-16-17)24-12-14-27-15-13-24/h1-7,16,19H,8-15H2.
What are the key properties of 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone?
2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone has a molecular weight of 367.45 g/mol, XLogP of 1.20, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-2-pyridin-3-yl-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone is sourced from PubChem (CID 72928474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).