6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione

C12H20N4O3 — CID 2497425

IUPAC6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione
SMILESCOCCn1c(N)c(N2CCCCC2)c(=O)[nH]c1=O
InChIInChI=1S/C12H20N4O3/c1-19-8-7-16-10(13)9(11(17)14-12(16)18)15-5-3-2-4-6-15/h2-8,13H2,1H3,(H,14,17,18)
InChIKeyWQDMJJWAWFCGHB-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.24
Rot. Bonds4

About 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione

6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione (PubChem CID 2497425) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione
PubChem CID2497425
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione
SMILESCOCCn1c(N)c(N2CCCCC2)c(=O)[nH]c1=O
InChIInChI=1S/C12H20N4O3/c1-19-8-7-16-10(13)9(11(17)14-12(16)18)15-5-3-2-4-6-15/h2-8,13H2,1H3,(H,14,17,18)
InChIKeyWQDMJJWAWFCGHB-UHFFFAOYSA-N
XLogP-0.24
TPSA93.35 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-hexyl-5-morpholin-4-yl-2,4-dioxopyrimidine-1-carboxamide
CID 71654888
6-Amino-1-methyl-5-(1-piperidinyl)-2,4(1H,3H)-pyrimidinedione
CID 2497562
N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-(2-methylpropyl)-2-morpholin-4-ylacetamide
CID 2469949
N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-2-morpholin-4-ylacetamide
CID 2549186
N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-N-butyl-2-(2,6-dimethylmorpholin-4-yl)acetamide
CID 4968872
6-Amino-5-{[2-(morpholin-4-yl)ethyl]amino}-1-propyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2398060
6-Amino-5-((2-methoxyethyl)amino)-1-propyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2113051
6-Amino-5-[(2-methoxyethyl)amino]-1-(2-methylpropyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2490480
6-Amino-5-(piperidin-1-yl)-1-propyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 2497579
N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-2-(azepan-1-yl)-N-(2-methoxyethyl)acetamide
CID 4855639
6-Amino-1-butyl-3-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]-5-morpholin-4-ylpyrimidine-2,4-dione
CID 4878498
6-Amino-1-isobutyl-5-[isobutyl(2-methoxyethyl)amino]-2,4(1h,3h)-pyrimidinedione
CID 45810893

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione (CID 2497425) is 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione is COCCn1c(N)c(N2CCCCC2)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione?
The InChIKey is WQDMJJWAWFCGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-19-8-7-16-10(13)9(11(17)14-12(16)18)15-5-3-2-4-6-15/h2-8,13H2,1H3,(H,14,17,18).
What are the key properties of 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione?
6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione has a molecular weight of 268.32 g/mol, XLogP of -0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-(2-methoxyethyl)-5-piperidin-1-ylpyrimidine-2,4-dione is sourced from PubChem (CID 2497425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).