3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide

C15H24N4O4 — CID 37251258

IUPAC3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide
SMILESCc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NC[C@H](C)N1CCOCC1
InChIInChI=1S/C15H24N4O4/c1-10(19-5-7-23-8-6-19)9-16-13(20)4-3-12-11(2)17-15(22)18-14(12)21/h10H,3-9H2,1-2H3,(H,16,20)(H2,17,18,21,22)/t10-/m0/s1
InChIKeyOURMXZGXHLKONP-JTQLQIEISA-N
MW324.38 g/mol
LogP-0.86
Rot. Bonds6

About 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide

3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide (PubChem CID 37251258) has the molecular formula C15H24N4O4 and a molecular weight of 324.38 g/mol. Its IUPAC name is 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide.

Molecular Properties

Compound Name3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide
PubChem CID37251258
Molecular FormulaC15H24N4O4
Molecular Weight324.38 g/mol
Exact Mass324.18
IUPAC Name3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide
SMILESCc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NC[C@H](C)N1CCOCC1
InChIInChI=1S/C15H24N4O4/c1-10(19-5-7-23-8-6-19)9-16-13(20)4-3-12-11(2)17-15(22)18-14(12)21/h10H,3-9H2,1-2H3,(H,16,20)(H2,17,18,21,22)/t10-/m0/s1
InChIKeyOURMXZGXHLKONP-JTQLQIEISA-N
XLogP-0.86
TPSA107.29 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide?
The IUPAC name of 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide (CID 37251258) is 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide.
What is the SMILES notation for 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide?
The canonical SMILES for 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide is Cc1[nH]c(=O)[nH]c(=O)c1CCC(=O)NC[C@H](C)N1CCOCC1.
What is the InChIKey of 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide?
The InChIKey is OURMXZGXHLKONP-JTQLQIEISA-N. The full InChI is InChI=1S/C15H24N4O4/c1-10(19-5-7-23-8-6-19)9-16-13(20)4-3-12-11(2)17-15(22)18-14(12)21/h10H,3-9H2,1-2H3,(H,16,20)(H2,17,18,21,22)/t10-/m0/s1.
What are the key properties of 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide?
3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide has a molecular weight of 324.38 g/mol, XLogP of -0.86, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-N-[(2S)-2-morpholin-4-ylpropyl]propanamide is sourced from PubChem (CID 37251258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).