4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one

C18H23N5O2 — CID 155560163

IUPAC4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one
SMILESO=c1nc(N2CCC(N3CCOCC3)CC2)cc(-c2cccnc2)[nH]1
InChIInChI=1S/C18H23N5O2/c24-18-20-16(14-2-1-5-19-13-14)12-17(21-18)23-6-3-15(4-7-23)22-8-10-25-11-9-22/h1-2,5,12-13,15H,3-4,6-11H2,(H,20,21,24)
InChIKeyWGYPQNMIDQVPBU-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.13
Rot. Bonds3

About 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one

4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one (PubChem CID 155560163) has the molecular formula C18H23N5O2 and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one.

Molecular Properties

Compound Name4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one
PubChem CID155560163
Molecular FormulaC18H23N5O2
Molecular Weight341.41 g/mol
Exact Mass341.19
IUPAC Name4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one
SMILESO=c1nc(N2CCC(N3CCOCC3)CC2)cc(-c2cccnc2)[nH]1
InChIInChI=1S/C18H23N5O2/c24-18-20-16(14-2-1-5-19-13-14)12-17(21-18)23-6-3-15(4-7-23)22-8-10-25-11-9-22/h1-2,5,12-13,15H,3-4,6-11H2,(H,20,21,24)
InChIKeyWGYPQNMIDQVPBU-UHFFFAOYSA-N
XLogP1.13
TPSA74.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

7-Methyl-2-morpholin-4-yl-9-(pyridin-2-ylmethylamino)pyrido[1,2-a]pyrimidin-4-one
CID 10066542
7-Methyl-2-morpholin-4-yl-9-(pyridin-4-ylmethylamino)pyrido[1,2-a]pyrimidin-4-one
CID 23586721
5-(4,6-Dimorpholino-1,3,5-triazin-2-yl)pyridin-2-amine
CID 46202650
1-Hydroxy-4-(4-morpholinoanilino)pyrido[2,3-d]pyrimidin-2-one
CID 90645175
1-Hydroxy-4-[4-(morpholinomethyl)anilino]pyrido[2,3-d]pyrimidin-2-one
CID 90645176
(4-Chloro-6-morpholin-4-yl-[1,3,5]triazin-2-yl)-pyridin-3-ylmethyl-amine
CID 684642
2-Imino-10-methyl-N-(2-(4-morpholinyl)ethyl)-5-oxo-1-(3-pyridinylmethyl)-1,5-dihydro-2H-dipyrido(1,2-A:2,3-D)pyrimidine-3-carboxamide
CID 1309471
4,6-di(morpholin-4-yl)-N-(pyridin-3-ylmethyl)-1,3,5-triazin-2-amine
CID 1110091
1-Hydroxy-4-[(3-morpholinophenyl)methylamino]pyrido[2,3-d]pyrimidin-2-one
CID 53257755
1-Hydroxy-4-[(4-morpholinophenyl)methylamino]pyrido[2,3-d]pyrimidin-2-one
CID 53258205
7-Methyl-2-morpholin-4-yl-9-(pyridin-3-ylmethylamino)pyrido[1,2-a]pyrimidin-4-one
CID 122179710
4-[Cyclopentyl(pyridin-3-ylmethyl)amino]-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 155520224

Frequently Asked Questions

What is the IUPAC name of 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one?
The IUPAC name of 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one (CID 155560163) is 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one.
What is the SMILES notation for 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one?
The canonical SMILES for 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one is O=c1nc(N2CCC(N3CCOCC3)CC2)cc(-c2cccnc2)[nH]1.
What is the InChIKey of 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one?
The InChIKey is WGYPQNMIDQVPBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c24-18-20-16(14-2-1-5-19-13-14)12-17(21-18)23-6-3-15(4-7-23)22-8-10-25-11-9-22/h1-2,5,12-13,15H,3-4,6-11H2,(H,20,21,24).
What are the key properties of 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one?
4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one has a molecular weight of 341.41 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-morpholin-4-ylpiperidin-1-yl)-6-pyridin-3-yl-1H-pyrimidin-2-one is sourced from PubChem (CID 155560163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).