4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one

C16H24N4O3 — CID 136844271

IUPAC4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(C2CN(CC(=O)N3CCCCC3)CCO2)n1
InChIInChI=1S/C16H24N4O3/c1-12-9-14(21)18-16(17-12)13-10-19(7-8-23-13)11-15(22)20-5-3-2-4-6-20/h9,13H,2-8,10-11H2,1H3,(H,17,18,21)
InChIKeyRSXUSEDAPRUULQ-UHFFFAOYSA-N
MW320.39 g/mol
LogP0.46
Rot. Bonds3

About 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one

4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one (PubChem CID 136844271) has the molecular formula C16H24N4O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one
PubChem CID136844271
Molecular FormulaC16H24N4O3
Molecular Weight320.39 g/mol
Exact Mass320.18
IUPAC Name4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one
SMILESCc1cc(=O)[nH]c(C2CN(CC(=O)N3CCCCC3)CCO2)n1
InChIInChI=1S/C16H24N4O3/c1-12-9-14(21)18-16(17-12)13-10-19(7-8-23-13)11-15(22)20-5-3-2-4-6-20/h9,13H,2-8,10-11H2,1H3,(H,17,18,21)
InChIKeyRSXUSEDAPRUULQ-UHFFFAOYSA-N
XLogP0.46
TPSA78.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one?
The IUPAC name of 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one (CID 136844271) is 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one?
The canonical SMILES for 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one is Cc1cc(=O)[nH]c(C2CN(CC(=O)N3CCCCC3)CCO2)n1.
What is the InChIKey of 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one?
The InChIKey is RSXUSEDAPRUULQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O3/c1-12-9-14(21)18-16(17-12)13-10-19(7-8-23-13)11-15(22)20-5-3-2-4-6-20/h9,13H,2-8,10-11H2,1H3,(H,17,18,21).
What are the key properties of 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one?
4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one has a molecular weight of 320.39 g/mol, XLogP of 0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)morpholin-2-yl]-1H-pyrimidin-6-one is sourced from PubChem (CID 136844271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).