4-[ethyl(methyl)amino]-1H-pyrimidin-6-one

C7H11N3O — CID 136504671

IUPAC4-[ethyl(methyl)amino]-1H-pyrimidin-6-one
SMILESCCN(C)c1cc(=O)[nH]cn1
InChIInChI=1S/C7H11N3O/c1-3-10(2)6-4-7(11)9-5-8-6/h4-5H,3H2,1-2H3,(H,8,9,11)
InChIKeyRJMHPHQBWZWDPY-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.23
Rot. Bonds2

About 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one

4-[ethyl(methyl)amino]-1H-pyrimidin-6-one (PubChem CID 136504671) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[ethyl(methyl)amino]-1H-pyrimidin-6-one
PubChem CID136504671
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name4-[ethyl(methyl)amino]-1H-pyrimidin-6-one
SMILESCCN(C)c1cc(=O)[nH]cn1
InChIInChI=1S/C7H11N3O/c1-3-10(2)6-4-7(11)9-5-8-6/h4-5H,3H2,1-2H3,(H,8,9,11)
InChIKeyRJMHPHQBWZWDPY-UHFFFAOYSA-N
XLogP0.23
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-hydroxybutyl(methyl)amino]-1H-pyrimidin-6-one
CID 135453817
4-[3-aminobutyl(methyl)amino]-1H-pyrimidin-6-one
CID 137008785
4-[5-hydroxypentyl(methyl)amino]-1H-pyrimidin-6-one
CID 136766323
4-[methyl(2-pyridin-2-ylethyl)amino]-1H-pyrimidin-6-one
CID 137015587
4-[2,1,3-benzothiadiazol-5-ylmethyl(methyl)amino]-1H-pyrimidin-6-one
CID 137314002
3-[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]butanethioamide
CID 136973209
3-[[methyl-(6-oxo-1H-pyrimidin-4-yl)amino]methyl]benzonitrile
CID 137015999
4-[bis(2-aminoethyl)amino]-1H-pyrimidin-6-one
CID 137008121
4-ethyl-1H-pyrimidin-6-one
CID 135407688
4-[[2-(aminomethyl)phenyl]methyl-ethylamino]-1H-pyrimidin-6-one
CID 136972726
4-[(3-aminophenyl)methyl-ethylamino]-1H-pyrimidin-6-one
CID 136979201
4-[methyl-[4-(propylamino)cyclohexyl]amino]-1H-pyrimidin-6-one
CID 136958273

Frequently Asked Questions

What is the IUPAC name of 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one?
The IUPAC name of 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one (CID 136504671) is 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one?
The canonical SMILES for 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one is CCN(C)c1cc(=O)[nH]cn1.
What is the InChIKey of 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one?
The InChIKey is RJMHPHQBWZWDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-3-10(2)6-4-7(11)9-5-8-6/h4-5H,3H2,1-2H3,(H,8,9,11).
What are the key properties of 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one?
4-[ethyl(methyl)amino]-1H-pyrimidin-6-one has a molecular weight of 153.19 g/mol, XLogP of 0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[ethyl(methyl)amino]-1H-pyrimidin-6-one is sourced from PubChem (CID 136504671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).