5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one

C10H17N3O — CID 164872350

IUPAC5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one
SMILESCCc1cn(C(C)C)c(=O)nc1NC
InChIInChI=1S/C10H17N3O/c1-5-8-6-13(7(2)3)10(14)12-9(8)11-4/h6-7H,5H2,1-4H3,(H,11,12,14)
InChIKeyMTCMXUNAAKSCAY-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.43
Rot. Bonds3

About 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one

5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one (PubChem CID 164872350) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one.

Molecular Properties

Compound Name5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one
PubChem CID164872350
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one
SMILESCCc1cn(C(C)C)c(=O)nc1NC
InChIInChI=1S/C10H17N3O/c1-5-8-6-13(7(2)3)10(14)12-9(8)11-4/h6-7H,5H2,1-4H3,(H,11,12,14)
InChIKeyMTCMXUNAAKSCAY-UHFFFAOYSA-N
XLogP1.43
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[5-amino-6-(methylamino)-3-phenylpyrazin-2-yl]-1-propan-2-ylpyridin-2-one
CID 69103594
4-amino-5-chloro-1-propan-2-ylpyrimidin-2-one
CID 167120999
1,5-dimethyl-4-(methylamino)pyrimidin-2-one
CID 10351878
3-ethyl-N-methylpyridin-2-amine;dihydrochloride
CID 70603683
5,6-difluoro-3-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidin-2-one
CID 122543789
6-fluoro-5-methyl-3-propan-2-yl-7H-pyrrolo[2,3-d]pyrimidin-2-one
CID 122543788
3-ethyl-N-methylpyridin-2-amine;molecular hydrogen
CID 177195094
ethene;3-ethyl-N-methylpyridin-2-amine
CID 143712916
5-fluoro-3-propan-2-yl-8H-pyrido[2,3-d]pyrimidine-2,7-dione
CID 122543623
4-amino-5-[(E)-3-aminoprop-1-enyl]-1-propan-2-ylpyrimidin-2-one
CID 118067941
3-ethyl-5-fluoro-1-propan-2-ylpyridin-2-one
CID 138466467
5-methyl-1-propan-2-ylpyrimidin-2-one
CID 58336934

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one?
The IUPAC name of 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one (CID 164872350) is 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one.
What is the SMILES notation for 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one?
The canonical SMILES for 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one is CCc1cn(C(C)C)c(=O)nc1NC.
What is the InChIKey of 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one?
The InChIKey is MTCMXUNAAKSCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-5-8-6-13(7(2)3)10(14)12-9(8)11-4/h6-7H,5H2,1-4H3,(H,11,12,14).
What are the key properties of 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one?
5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one has a molecular weight of 195.27 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-(methylamino)-1-propan-2-ylpyrimidin-2-one is sourced from PubChem (CID 164872350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).