1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one

C17H25N3O3 — CID 75461257

IUPAC1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one
SMILESCn1ccc(C(=O)N2CCC(CN3CCOCC3)CC2)cc1=O
InChIInChI=1S/C17H25N3O3/c1-18-5-4-15(12-16(18)21)17(22)20-6-2-14(3-7-20)13-19-8-10-23-11-9-19/h4-5,12,14H,2-3,6-11,13H2,1H3
InChIKeyWUEGCCLBTNKYLZ-UHFFFAOYSA-N
MW319.40 g/mol
LogP0.57
Rot. Bonds3

About 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one

1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one (PubChem CID 75461257) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one.

Molecular Properties

Compound Name1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one
PubChem CID75461257
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one
SMILESCn1ccc(C(=O)N2CCC(CN3CCOCC3)CC2)cc1=O
InChIInChI=1S/C17H25N3O3/c1-18-5-4-15(12-16(18)21)17(22)20-6-2-14(3-7-20)13-19-8-10-23-11-9-19/h4-5,12,14H,2-3,6-11,13H2,1H3
InChIKeyWUEGCCLBTNKYLZ-UHFFFAOYSA-N
XLogP0.57
TPSA54.78 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one?
The IUPAC name of 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one (CID 75461257) is 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one.
What is the SMILES notation for 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one?
The canonical SMILES for 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one is Cn1ccc(C(=O)N2CCC(CN3CCOCC3)CC2)cc1=O.
What is the InChIKey of 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one?
The InChIKey is WUEGCCLBTNKYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-18-5-4-15(12-16(18)21)17(22)20-6-2-14(3-7-20)13-19-8-10-23-11-9-19/h4-5,12,14H,2-3,6-11,13H2,1H3.
What are the key properties of 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one?
1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one has a molecular weight of 319.40 g/mol, XLogP of 0.57, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[4-(morpholin-4-ylmethyl)piperidine-1-carbonyl]pyridin-2-one is sourced from PubChem (CID 75461257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).