2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one

C10H16N4O — CID 84676229

IUPAC2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one
SMILESCn1c(CN)nc(N2CCCC2)cc1=O
InChIInChI=1S/C10H16N4O/c1-13-9(7-11)12-8(6-10(13)15)14-4-2-3-5-14/h6H,2-5,7,11H2,1H3
InChIKeyAZWJUDVOMJJLTA-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.16
Rot. Bonds2

About 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one

2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one (PubChem CID 84676229) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one.

Molecular Properties

Compound Name2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one
PubChem CID84676229
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one
SMILESCn1c(CN)nc(N2CCCC2)cc1=O
InChIInChI=1S/C10H16N4O/c1-13-9(7-11)12-8(6-10(13)15)14-4-2-3-5-14/h6H,2-5,7,11H2,1H3
InChIKeyAZWJUDVOMJJLTA-UHFFFAOYSA-N
XLogP-0.16
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(Aminomethyl)-6-(dimethylamino)-3-methylpyrimidin-4-one
CID 84658554
2-Amino-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one
CID 84665523
2-(1-Aminoethyl)-6-(dimethylamino)-3-methylpyrimidin-4-one
CID 84667044
2-(1-Aminoethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one
CID 84687778
2-(2-Aminoethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one
CID 84687779
2-(Aminomethyl)-3-methyl-6-piperidin-1-ylpyrimidin-4-one
CID 84687782
2-(3-Aminopropyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one
CID 84699556
2-(Aminomethyl)-6-(azepan-1-yl)-3-methylpyrimidin-4-one
CID 84699561
6-Chloro-2-methyl-3-(2-pyrrolidin-1-ylethyl)pyrimidin-4-one
CID 114581830
6-Chloro-2-methyl-3-[2-(2-oxoimidazolidin-1-yl)ethyl]pyrimidin-4-one
CID 114581849
6-Chloro-2-ethyl-3-(2-pyrrolidin-1-ylethyl)pyrimidin-4-one
CID 114584356
2-(3-aminopropyl)-4-pyrrolidin-1-yl-1H-pyrimidin-6-one
CID 136314514

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one?
The IUPAC name of 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one (CID 84676229) is 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one.
What is the SMILES notation for 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one?
The canonical SMILES for 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one is Cn1c(CN)nc(N2CCCC2)cc1=O.
What is the InChIKey of 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one?
The InChIKey is AZWJUDVOMJJLTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-13-9(7-11)12-8(6-10(13)15)14-4-2-3-5-14/h6H,2-5,7,11H2,1H3.
What are the key properties of 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one?
2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one has a molecular weight of 208.26 g/mol, XLogP of -0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-3-methyl-6-pyrrolidin-1-ylpyrimidin-4-one is sourced from PubChem (CID 84676229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).