4-amino-1-ethyl-5-methylpyrimidin-2-one

C7H11N3O — CID 15218124

IUPAC4-amino-1-ethyl-5-methylpyrimidin-2-one
SMILESCCn1cc(C)c(N)nc1=O
InChIInChI=1S/C7H11N3O/c1-3-10-4-5(2)6(8)9-7(10)11/h4H,3H2,1-2H3,(H2,8,9,11)
InChIKeyRZSBPSHFIILPJP-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.15
Rot. Bonds1

About 4-amino-1-ethyl-5-methylpyrimidin-2-one

4-amino-1-ethyl-5-methylpyrimidin-2-one (PubChem CID 15218124) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 4-amino-1-ethyl-5-methylpyrimidin-2-one.

Molecular Properties

Compound Name4-amino-1-ethyl-5-methylpyrimidin-2-one
PubChem CID15218124
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name4-amino-1-ethyl-5-methylpyrimidin-2-one
SMILESCCn1cc(C)c(N)nc1=O
InChIInChI=1S/C7H11N3O/c1-3-10-4-5(2)6(8)9-7(10)11/h4H,3H2,1-2H3,(H2,8,9,11)
InChIKeyRZSBPSHFIILPJP-UHFFFAOYSA-N
XLogP0.15
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-5-methylpyrimidin-2-one?
The IUPAC name of 4-amino-1-ethyl-5-methylpyrimidin-2-one (CID 15218124) is 4-amino-1-ethyl-5-methylpyrimidin-2-one.
What is the SMILES notation for 4-amino-1-ethyl-5-methylpyrimidin-2-one?
The canonical SMILES for 4-amino-1-ethyl-5-methylpyrimidin-2-one is CCn1cc(C)c(N)nc1=O.
What is the InChIKey of 4-amino-1-ethyl-5-methylpyrimidin-2-one?
The InChIKey is RZSBPSHFIILPJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-3-10-4-5(2)6(8)9-7(10)11/h4H,3H2,1-2H3,(H2,8,9,11).
What are the key properties of 4-amino-1-ethyl-5-methylpyrimidin-2-one?
4-amino-1-ethyl-5-methylpyrimidin-2-one has a molecular weight of 153.18 g/mol, XLogP of 0.15, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-5-methylpyrimidin-2-one is sourced from PubChem (CID 15218124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).