3-ethyl-6-methyl-2-propylpyrimidin-4-one

C10H16N2O — CID 134868748

IUPAC3-ethyl-6-methyl-2-propylpyrimidin-4-one
SMILESCCCc1nc(C)cc(=O)n1CC
InChIInChI=1S/C10H16N2O/c1-4-6-9-11-8(3)7-10(13)12(9)5-2/h7H,4-6H2,1-3H3
InChIKeyFFHHPGPTFKFFEV-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.52
Rot. Bonds3

About 3-ethyl-6-methyl-2-propylpyrimidin-4-one

3-ethyl-6-methyl-2-propylpyrimidin-4-one (PubChem CID 134868748) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 3-ethyl-6-methyl-2-propylpyrimidin-4-one.

Molecular Properties

Compound Name3-ethyl-6-methyl-2-propylpyrimidin-4-one
PubChem CID134868748
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name3-ethyl-6-methyl-2-propylpyrimidin-4-one
SMILESCCCc1nc(C)cc(=O)n1CC
InChIInChI=1S/C10H16N2O/c1-4-6-9-11-8(3)7-10(13)12(9)5-2/h7H,4-6H2,1-3H3
InChIKeyFFHHPGPTFKFFEV-UHFFFAOYSA-N
XLogP1.52
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4H-pyrido(1,2-a)pyrimidin-4-one, 6,7,8,9-tetrahydro-2-methyl-
CID 529095
2-methyl-7,8,9,10-tetrahydropyrimido[1,2-a]azepin-4(6H)-one
CID 718922
4(3H)-Pyrimidinone, 2,3,6-trimethyl-
CID 544953
2-Methyl-4h,6h,7h,8h-pyrrolo[1,2-a]pyrimidin-4-one
CID 1571397
3,6-Dimethyl-2-propylpyrimidin-4-one
CID 89662153
4(3H)-Pyrimidinone, 2-ethyl-3,6-dimethyl-
CID 551082
3,6-Dimethyl-2-propan-2-ylpyrimidin-4-one
CID 13123700
3-Ethyl-6-methyl-2-propan-2-ylpyrimidin-4-one
CID 13123701
3-(2,4-Dimethyl-6-oxopyrimidin-1-yl)prop-1-en-2-yl-trifluoroboranuide
CID 106746400
2-Cyclopropyl-6-methyl-3-(2,2,2-trifluoroethyl)-3,4-dihydropyrimidin-4-one
CID 126857772
4(3H)-Pyrimidinone, 3-ethyl-2,6-dimethyl-
CID 592279
1,6-Dimethyl-2-propan-2-ylpyrimidin-4-one
CID 13666605

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-methyl-2-propylpyrimidin-4-one?
The IUPAC name of 3-ethyl-6-methyl-2-propylpyrimidin-4-one (CID 134868748) is 3-ethyl-6-methyl-2-propylpyrimidin-4-one.
What is the SMILES notation for 3-ethyl-6-methyl-2-propylpyrimidin-4-one?
The canonical SMILES for 3-ethyl-6-methyl-2-propylpyrimidin-4-one is CCCc1nc(C)cc(=O)n1CC.
What is the InChIKey of 3-ethyl-6-methyl-2-propylpyrimidin-4-one?
The InChIKey is FFHHPGPTFKFFEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-4-6-9-11-8(3)7-10(13)12(9)5-2/h7H,4-6H2,1-3H3.
What are the key properties of 3-ethyl-6-methyl-2-propylpyrimidin-4-one?
3-ethyl-6-methyl-2-propylpyrimidin-4-one has a molecular weight of 180.25 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-methyl-2-propylpyrimidin-4-one is sourced from PubChem (CID 134868748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).