5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione

C10H15N3O2 — CID 17275060

IUPAC5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione
SMILESCC1CCN(c2c[nH]c(=O)[nH]c2=O)CC1
InChIInChI=1S/C10H15N3O2/c1-7-2-4-13(5-3-7)8-6-11-10(15)12-9(8)14/h6-7H,2-5H2,1H3,(H2,11,12,14,15)
InChIKeyOVHQUVQUAVTIED-UHFFFAOYSA-N
MW209.25 g/mol
LogP0.30
Rot. Bonds1

About 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione

5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione (PubChem CID 17275060) has the molecular formula C10H15N3O2 and a molecular weight of 209.25 g/mol. Its IUPAC name is 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione
PubChem CID17275060
Molecular FormulaC10H15N3O2
Molecular Weight209.25 g/mol
Exact Mass209.12
IUPAC Name5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione
SMILESCC1CCN(c2c[nH]c(=O)[nH]c2=O)CC1
InChIInChI=1S/C10H15N3O2/c1-7-2-4-13(5-3-7)8-6-11-10(15)12-9(8)14/h6-7H,2-5H2,1H3,(H2,11,12,14,15)
InChIKeyOVHQUVQUAVTIED-UHFFFAOYSA-N
XLogP0.30
TPSA68.96 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-methylpiperazin-1-yl)-1H-pyrimidine-2,4-dione
CID 651501
5-(Cyclohexylmethylamino)-1,3-dihydropyrimidine-2,4-dione
CID 899001
N-hexyl-5-(4-methylpiperazin-1-yl)-2,4-dioxopyrimidine-1-carboxamide
CID 71654889
5-(piperidin-1-yl)pyrimidine-2,4(1H,3H)-dione
CID 745053
N-(2,4-dioxo-1H-pyrimidin-5-yl)-3-methylbutanamide
CID 2228116
N-[6-amino-1-(2-methylpropyl)-2,4-dioxopyrimidin-5-yl]-2-(4-methylpiperidin-1-yl)-N-(2-methylpropyl)acetamide
CID 2697798
4-[4-(3-Methylbutyl)piperazine-1-carbonyl]-1,3-dihydroimidazol-2-one
CID 53499787
N-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-2-ethylbutanamide
CID 3159468
1-(6-Amino-1-butyl-2,4-dioxopyrimidin-5-yl)piperidine-4-carboxamide
CID 4855112
1-[2-(4-Methylpiperidin-1-YL)-2-oxoethyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 26643718
5-[4-methoxy-4-(trifluoromethyl)piperidin-1-yl]-1H-pyrimidine-2,4-dione
CID 136573680
1,3-Dimethyl-5-[4-(trifluoromethyl)piperidin-1-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
CID 163345291

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione (CID 17275060) is 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione is CC1CCN(c2c[nH]c(=O)[nH]c2=O)CC1.
What is the InChIKey of 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione?
The InChIKey is OVHQUVQUAVTIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O2/c1-7-2-4-13(5-3-7)8-6-11-10(15)12-9(8)14/h6-7H,2-5H2,1H3,(H2,11,12,14,15).
What are the key properties of 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione?
5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione has a molecular weight of 209.25 g/mol, XLogP of 0.30, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperidin-1-yl)-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 17275060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).