4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one

C10H18N4O — CID 137297951

IUPAC4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one
SMILESCCN(CC)Cc1c(N)nc(C)[nH]c1=O
InChIInChI=1S/C10H18N4O/c1-4-14(5-2)6-8-9(11)12-7(3)13-10(8)15/h4-6H2,1-3H3,(H3,11,12,13,15)
InChIKeyCJGORLXQPVDORE-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.50
Rot. Bonds4

About 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one

4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one (PubChem CID 137297951) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one
PubChem CID137297951
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one
SMILESCCN(CC)Cc1c(N)nc(C)[nH]c1=O
InChIInChI=1S/C10H18N4O/c1-4-14(5-2)6-8-9(11)12-7(3)13-10(8)15/h4-6H2,1-3H3,(H3,11,12,13,15)
InChIKeyCJGORLXQPVDORE-UHFFFAOYSA-N
XLogP0.50
TPSA75.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-Amino-5-{[bis(2-hydroxyethyl)amino]methyl}-2-methylpyrimidin-4-ol
CID 135530274
3-Ethyl-2,5-dimethyl-6-(methylamino)pyrimidin-4-one
CID 18334352
6-(Ethylamino)-2,3,5-trimethylpyrimidin-4-one
CID 18334378
2-[3-[(2-methyl-6-oxo-1H-pyrimidin-5-yl)methylamino]propyl]guanidine
CID 66581406
2-[3-[(2-tert-butyl-6-oxo-1H-pyrimidin-5-yl)methylamino]propyl]guanidine
CID 89492717
4-[di(propan-2-yl)amino]-2,5-dimethyl-1H-pyrimidin-6-one
CID 136023885
4-(ethylamino)-2,5-dimethyl-1H-pyrimidin-6-one
CID 136081902
2-ethyl-4-(methylamino)-6-oxo-1H-pyrimidine-5-carboxamide
CID 142673329
2,5-dimethyl-1H-pyrimidin-6-one;ethane;molecular hydrogen
CID 168925529
2,5-dimethyl-1H-pyrimidin-6-one;ethane
CID 168925571
4-(dimethylamino)-2,5-dimethyl-1H-pyrimidin-6-one
CID 170231364
5-[(Diethylamino)methyl]-2-methylpyrimidine-4,6-diol
CID 3489833

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one?
The IUPAC name of 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one (CID 137297951) is 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one is CCN(CC)Cc1c(N)nc(C)[nH]c1=O.
What is the InChIKey of 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one?
The InChIKey is CJGORLXQPVDORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-4-14(5-2)6-8-9(11)12-7(3)13-10(8)15/h4-6H2,1-3H3,(H3,11,12,13,15).
What are the key properties of 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one?
4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one has a molecular weight of 210.28 g/mol, XLogP of 0.50, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-(diethylaminomethyl)-2-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 137297951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).