6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione

C12H21N5O3 — CID 78916170

IUPAC6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione
SMILESCCn1c(N)c(NCC2CN(C)CCO2)c(=O)[nH]c1=O
InChIInChI=1S/C12H21N5O3/c1-3-17-10(13)9(11(18)15-12(17)19)14-6-8-7-16(2)4-5-20-8/h8,14H,3-7,13H2,1-2H3,(H,15,18,19)
InChIKeyYYRYSGIJWSXQBW-UHFFFAOYSA-N
MW283.33 g/mol
LogP-1.12
Rot. Bonds4

About 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione

6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione (PubChem CID 78916170) has the molecular formula C12H21N5O3 and a molecular weight of 283.33 g/mol. Its IUPAC name is 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione
PubChem CID78916170
Molecular FormulaC12H21N5O3
Molecular Weight283.33 g/mol
Exact Mass283.16
IUPAC Name6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione
SMILESCCn1c(N)c(NCC2CN(C)CCO2)c(=O)[nH]c1=O
InChIInChI=1S/C12H21N5O3/c1-3-17-10(13)9(11(18)15-12(17)19)14-6-8-7-16(2)4-5-20-8/h8,14H,3-7,13H2,1-2H3,(H,15,18,19)
InChIKeyYYRYSGIJWSXQBW-UHFFFAOYSA-N
XLogP-1.12
TPSA105.38 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 5-1.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

6-amino-1-ethyl-5-(thian-4-ylmethylamino)pyrimidine-2,4-dione
CID 115625293
6-amino-5-(oxan-3-ylmethylamino)-1-propylpyrimidine-2,4-dione
CID 61019816
3-N-[(4-methylmorpholin-2-yl)methyl]-1H-1,2,4-triazole-3,5-diamine
CID 79071706
2,6-dichloro-1-N-[(4-methylmorpholin-2-yl)methyl]benzene-1,4-diamine
CID 106890563
6-amino-1-ethyl-5-[(1-methylcyclopropyl)methylamino]pyrimidine-2,4-dione
CID 113248927
6-amino-1-ethyl-5-(5-hydroxypentylamino)pyrimidine-2,4-dione
CID 107302596
6-amino-5-[(2,5-dimethylpyrrol-1-yl)amino]-1-ethylpyrimidine-2,4-dione
CID 79106040
5-chloro-4-[(4-methylmorpholin-2-yl)methylamino]-1H-pyridazin-6-one
CID 78952462
6-amino-1-methyl-5-(oxan-3-ylmethylamino)pyrimidine-2,4-dione
CID 54906132
6-amino-1-ethyl-5-(thiophen-3-ylmethylamino)pyrimidine-2,4-dione
CID 60966171
1-tert-butyl-6-[(4-methylmorpholin-2-yl)methylamino]-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 137264504
5-amino-6-[(4-methylmorpholin-2-yl)methylamino]-1,3-dihydroindol-2-one
CID 79082505

Frequently Asked Questions

What is the IUPAC name of 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione?
The IUPAC name of 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione (CID 78916170) is 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione.
What is the SMILES notation for 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione?
The canonical SMILES for 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione is CCn1c(N)c(NCC2CN(C)CCO2)c(=O)[nH]c1=O.
What is the InChIKey of 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione?
The InChIKey is YYRYSGIJWSXQBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O3/c1-3-17-10(13)9(11(18)15-12(17)19)14-6-8-7-16(2)4-5-20-8/h8,14H,3-7,13H2,1-2H3,(H,15,18,19).
What are the key properties of 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione?
6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione has a molecular weight of 283.33 g/mol, XLogP of -1.12, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-ethyl-5-[(4-methylmorpholin-2-yl)methylamino]pyrimidine-2,4-dione is sourced from PubChem (CID 78916170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).