2-(ethylamino)-4-methyl-1H-pyrimidin-6-one

C7H11N3O — CID 135840406

IUPAC2-(ethylamino)-4-methyl-1H-pyrimidin-6-one
SMILESCCNc1nc(C)cc(=O)[nH]1
InChIInChI=1S/C7H11N3O/c1-3-8-7-9-5(2)4-6(11)10-7/h4H,3H2,1-2H3,(H2,8,9,10,11)
InChIKeyFGGJSYHDZAQGEL-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.51
Rot. Bonds2

About 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one

2-(ethylamino)-4-methyl-1H-pyrimidin-6-one (PubChem CID 135840406) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(ethylamino)-4-methyl-1H-pyrimidin-6-one
PubChem CID135840406
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name2-(ethylamino)-4-methyl-1H-pyrimidin-6-one
SMILESCCNc1nc(C)cc(=O)[nH]1
InChIInChI=1S/C7H11N3O/c1-3-8-7-9-5(2)4-6(11)10-7/h4H,3H2,1-2H3,(H2,8,9,10,11)
InChIKeyFGGJSYHDZAQGEL-UHFFFAOYSA-N
XLogP0.51
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(dimethylamino)ethylamino]-4-methyl-1H-pyrimidin-6-one
CID 135462793
ethane;4-methyl-2-(methylamino)-1H-pyrimidin-6-one
CID 145166699
2-(ethylamino)-4-(trifluoromethyl)-1H-pyrimidin-6-one
CID 135484722
4-methyl-2-(2-phenylethylamino)-1H-pyrimidin-6-one
CID 135527667
N-(4-methyl-6-oxo-1H-pyrimidin-2-yl)nitrous amide
CID 137229327
2-[(2-chlorophenyl)methylamino]-4-methyl-1H-pyrimidin-6-one
CID 135764107
2-(2-butan-2-ylidenehydrazinyl)-4-methyl-1H-pyrimidin-6-one
CID 135521075
4-[[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]methyl]benzoic acid
CID 135610198
2-chloro-N-(4-methyl-6-oxo-1H-pyrimidin-2-yl)acetamide
CID 135511505
2-[(2-methoxyphenyl)methylamino]-4-methyl-1H-pyrimidin-6-one
CID 135816304
4-methyl-2-(pyrimidin-2-ylamino)-1H-pyrimidin-6-one
CID 137003975
(2R)-2-amino-3-methyl-N-[2-[(4-methyl-6-oxo-1H-pyrimidin-2-yl)amino]ethyl]butanamide
CID 136662261

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one?
The IUPAC name of 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one (CID 135840406) is 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one is CCNc1nc(C)cc(=O)[nH]1.
What is the InChIKey of 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one?
The InChIKey is FGGJSYHDZAQGEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-3-8-7-9-5(2)4-6(11)10-7/h4H,3H2,1-2H3,(H2,8,9,10,11).
What are the key properties of 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one?
2-(ethylamino)-4-methyl-1H-pyrimidin-6-one has a molecular weight of 153.18 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-4-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 135840406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).