2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one

C10H16N4O — CID 84676232

IUPAC2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one
SMILESCn1c(N)nc(N2CCCCC2)cc1=O
InChIInChI=1S/C10H16N4O/c1-13-9(15)7-8(12-10(13)11)14-5-3-2-4-6-14/h7H,2-6H2,1H3,(H2,11,12)
InChIKeyKJVBQWZSUSSOFF-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.35
Rot. Bonds1

About 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one

2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one (PubChem CID 84676232) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one.

Molecular Properties

Compound Name2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one
PubChem CID84676232
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one
SMILESCn1c(N)nc(N2CCCCC2)cc1=O
InChIInChI=1S/C10H16N4O/c1-13-9(15)7-8(12-10(13)11)14-5-3-2-4-6-14/h7H,2-6H2,1H3,(H2,11,12)
InChIKeyKJVBQWZSUSSOFF-UHFFFAOYSA-N
XLogP0.35
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 ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(Piperidin-1-yl)-3,4-dihydropyrimidin-4-one
CID 136957380
1,3-Dimethyl-6-(piperidinomethyleneamino)pyrimidine-2,4-dione
CID 129789057
2-amino-6-[4-(5-fluoropentyl)piperazin-1-yl]pyrimidin-4(3H)-one
CID 136663750
Cwpakppsuvqhbb-uhfffaoysa-
CID 10013741
6-amino-2-(4-methylpiperidin-1-yl)pyrimidin-4(3H)-one
CID 135638182
6-Amino-2-(3-methyl-1-piperidinyl)-4(3H)-pyrimidinone
CID 135646473
2,3-Dimethyl-6-piperidin-1-ylpyrimidin-4-one
CID 67744616
2-(4-Aminopiperidin-1-yl)-6-chloro-3-ethylpyrimidin-4-one
CID 123183196
6-amino-2-piperidin-1-ylpyrimidin-4(3H)-one
CID 135587490
4-amino-2-[4-(aminomethyl)-4-methylpiperidin-1-yl]-1H-pyrimidin-6-one
CID 173826255
6-Amino-2-(4-amino-4-methylpiperidin-1-yl)-3-methylpyrimidin-4-one
CID 175829400
6-Amino-2-(4-amino-4-methylpiperidin-1-yl)-5-deuterio-3-methylpyrimidin-4-one
CID 175829454

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one?
The IUPAC name of 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one (CID 84676232) is 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one.
What is the SMILES notation for 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one?
The canonical SMILES for 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one is Cn1c(N)nc(N2CCCCC2)cc1=O.
What is the InChIKey of 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one?
The InChIKey is KJVBQWZSUSSOFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-13-9(15)7-8(12-10(13)11)14-5-3-2-4-6-14/h7H,2-6H2,1H3,(H2,11,12).
What are the key properties of 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one?
2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one has a molecular weight of 208.26 g/mol, XLogP of 0.35, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methyl-6-piperidin-1-ylpyrimidin-4-one is sourced from PubChem (CID 84676232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).