2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one

C10H16N4O2 — CID 136706919

IUPAC2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one
SMILESCc1nc(NCC2COCCN2)cc(=O)[nH]1
InChIInChI=1S/C10H16N4O2/c1-7-13-9(4-10(15)14-7)12-5-8-6-16-3-2-11-8/h4,8,11H,2-3,5-6H2,1H3,(H2,12,13,14,15)
InChIKeyGDYKYYYJNPVBJS-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.52
Rot. Bonds3

About 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one

2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one (PubChem CID 136706919) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one
PubChem CID136706919
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one
SMILESCc1nc(NCC2COCCN2)cc(=O)[nH]1
InChIInChI=1S/C10H16N4O2/c1-7-13-9(4-10(15)14-7)12-5-8-6-16-3-2-11-8/h4,8,11H,2-3,5-6H2,1H3,(H2,12,13,14,15)
InChIKeyGDYKYYYJNPVBJS-UHFFFAOYSA-N
XLogP-0.52
TPSA79.04 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-Hydroxy-2-methyl-6-morpholinopyrimidine
CID 135592113
2-ethyl-4-(oxan-4-ylamino)-1H-pyrimidin-6-one
CID 136633030
ethyl 2-[4-(3-methylpiperazin-1-yl)-6-oxo-1H-pyrimidin-2-yl]acetate
CID 137092670
4-morpholin-4-yl-2-(propan-2-ylamino)-1H-pyrimidin-6-one
CID 156749632
2-(Aminomethyl)-3-methyl-6-morpholin-4-ylpyrimidin-4-one
CID 84689153
2-(1-Aminoethyl)-3-methyl-6-morpholin-4-ylpyrimidin-4-one
CID 84700722
2-(2-Aminoethyl)-3-methyl-6-morpholin-4-ylpyrimidin-4-one
CID 84700723
4-methyl-2-(morpholin-4-ium-4-ylmethyl)-1H-pyrimidin-6-one
CID 135737081
2-methyl-4-(morpholin-4-ium-4-ylmethyl)-1H-pyrimidin-6-one
CID 135737098
2-(1,4-dimethylpiperazin-2-yl)-4-[(2-methoxyethylamino)methyl]-1H-pyrimidin-6-one
CID 136295830
2-(1-aminoethyl)-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 136303151
2-(2-aminoethyl)-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 136303152

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one?
The IUPAC name of 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one (CID 136706919) is 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one?
The canonical SMILES for 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one is Cc1nc(NCC2COCCN2)cc(=O)[nH]1.
What is the InChIKey of 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one?
The InChIKey is GDYKYYYJNPVBJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-7-13-9(4-10(15)14-7)12-5-8-6-16-3-2-11-8/h4,8,11H,2-3,5-6H2,1H3,(H2,12,13,14,15).
What are the key properties of 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one?
2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one has a molecular weight of 224.26 g/mol, XLogP of -0.52, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(morpholin-3-ylmethylamino)-1H-pyrimidin-6-one is sourced from PubChem (CID 136706919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).