5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one

C9H15N5O2 — CID 139217219

IUPAC5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one
SMILESCn1c(N2CCOCC2)nc(N)c(N)c1=O
InChIInChI=1S/C9H15N5O2/c1-13-8(15)6(10)7(11)12-9(13)14-2-4-16-5-3-14/h2-5,10-11H2,1H3
InChIKeyUHTZHSQEITYSKW-UHFFFAOYSA-N
MW225.25 g/mol
LogP-1.22
Rot. Bonds1

About 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one

5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one (PubChem CID 139217219) has the molecular formula C9H15N5O2 and a molecular weight of 225.25 g/mol. Its IUPAC name is 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one.

Molecular Properties

Compound Name5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one
PubChem CID139217219
Molecular FormulaC9H15N5O2
Molecular Weight225.25 g/mol
Exact Mass225.12
IUPAC Name5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one
SMILESCn1c(N2CCOCC2)nc(N)c(N)c1=O
InChIInChI=1S/C9H15N5O2/c1-13-8(15)6(10)7(11)12-9(13)14-2-4-16-5-3-14/h2-5,10-11H2,1H3
InChIKeyUHTZHSQEITYSKW-UHFFFAOYSA-N
XLogP-1.22
TPSA99.40 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1,3,6-trimethyl-5-[(4-morpholinylmethylene)amino]-2,4(1H,3H)-pyrimidinedione
CID 2243497
6-Amino-3-methyl-2-(morpholin-4-yl)-5-nitrosopyrimidin-4(3h)-one
CID 91132632
6-Amino-2-morpholin-4-yl-5-nitrosopyrimidin-4-ol
CID 136185846
5-fluoro-4-methyl-2-morpholin-4-yl-1H-pyrimidin-6-one
CID 136228904
5-Amino-1,3-dimethyl-6-morpholin-4-ylpyrimidine-2,4-dione
CID 12294517
2-amino-5-morpholin-4-yl-1H-pyrimidin-6-one
CID 18432587
5-amino-2-morpholin-4-yl-1H-pyrimidin-6-one
CID 20276700
4,5-diamino-2-morpholin-4-yl-1H-pyrimidin-6-one
CID 135850746
2,5-diamino-4-morpholin-4-yl-1H-pyrimidin-6-one
CID 135850748
4-amino-5-morpholin-4-yl-1H-pyrimidin-6-one
CID 136393190
2-amino-5-(methylamino)-4-[(4-methylmorpholin-2-yl)amino]-1H-pyrimidin-6-one
CID 137179244
2-amino-4-[ethyl-(4-methylmorpholin-2-yl)amino]-5-[iodo(methyl)amino]-1H-pyrimidin-6-one
CID 137192395

Frequently Asked Questions

What is the IUPAC name of 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one?
The IUPAC name of 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one (CID 139217219) is 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one.
What is the SMILES notation for 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one?
The canonical SMILES for 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one is Cn1c(N2CCOCC2)nc(N)c(N)c1=O.
What is the InChIKey of 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one?
The InChIKey is UHTZHSQEITYSKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O2/c1-13-8(15)6(10)7(11)12-9(13)14-2-4-16-5-3-14/h2-5,10-11H2,1H3.
What are the key properties of 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one?
5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one has a molecular weight of 225.25 g/mol, XLogP of -1.22, 1 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diamino-3-methyl-2-morpholin-4-ylpyrimidin-4-one is sourced from PubChem (CID 139217219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).