5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one

C10H16N4O — CID 115114249

IUPAC5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one
SMILESCN1CCC(n2cnc(=O)c(N)c2)CC1
InChIInChI=1S/C10H16N4O/c1-13-4-2-8(3-5-13)14-6-9(11)10(15)12-7-14/h6-8H,2-5,11H2,1H3
InChIKeyZWLPXWWJOUOCHA-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.09
Rot. Bonds1

About 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one

5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one (PubChem CID 115114249) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one.

Molecular Properties

Compound Name5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one
PubChem CID115114249
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one
SMILESCN1CCC(n2cnc(=O)c(N)c2)CC1
InChIInChI=1S/C10H16N4O/c1-13-4-2-8(3-5-13)14-6-9(11)10(15)12-7-14/h6-8H,2-5,11H2,1H3
InChIKeyZWLPXWWJOUOCHA-UHFFFAOYSA-N
XLogP0.09
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[3-(methylamino)piperidin-1-yl]-1H-pyrimidin-6-one;hydrobromide
CID 162725265
5-[3-(methylamino)piperidin-1-yl]-1H-pyrimidin-6-one
CID 162725266
5-piperidin-1-yl-1H-pyrimidin-6-one
CID 175499718
5-Amino-1-(1-methylpyrrolidin-3-yl)pyrimidin-4-one
CID 115114237
5-(Aminomethyl)-1-(1-methylpiperidin-4-yl)pyrimidin-4-one
CID 115114245
5-Amino-1-piperidin-4-ylpyrimidin-4-one
CID 115114248
5-Amino-1-(piperidin-4-ylmethyl)pyrimidin-4-one
CID 115114272
5-Amino-1-[(1-methylpiperidin-4-yl)methyl]pyrimidin-4-one
CID 115114273
5-(Aminomethyl)-1-(1-methylpiperidin-3-yl)pyrimidin-4-one
CID 115114281
5-Amino-1-piperidin-3-ylpyrimidin-4-one
CID 115114284
5-Amino-1-(1-methylpiperidin-3-yl)pyrimidin-4-one
CID 115114285
5-Amino-1-piperidin-2-ylpyrimidin-4-one
CID 115114308

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one?
The IUPAC name of 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one (CID 115114249) is 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one.
What is the SMILES notation for 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one?
The canonical SMILES for 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one is CN1CCC(n2cnc(=O)c(N)c2)CC1.
What is the InChIKey of 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one?
The InChIKey is ZWLPXWWJOUOCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-13-4-2-8(3-5-13)14-6-9(11)10(15)12-7-14/h6-8H,2-5,11H2,1H3.
What are the key properties of 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one?
5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one has a molecular weight of 208.26 g/mol, XLogP of 0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(1-methylpiperidin-4-yl)pyrimidin-4-one is sourced from PubChem (CID 115114249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).