2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one

C14H20N4OS — CID 135992610

IUPAC2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one
SMILESCc1csc(C(C)NC(C)c2c(C)nc(C)[nH]c2=O)n1
InChIInChI=1S/C14H20N4OS/c1-7-6-20-14(15-7)10(4)16-8(2)12-9(3)17-11(5)18-13(12)19/h6,8,10,16H,1-5H3,(H,17,18,19)
InChIKeyBODPWYZRTYCXHD-UHFFFAOYSA-N
MW292.41 g/mol
LogP2.56
Rot. Bonds4

About 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one

2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one (PubChem CID 135992610) has the molecular formula C14H20N4OS and a molecular weight of 292.41 g/mol. Its IUPAC name is 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one
PubChem CID135992610
Molecular FormulaC14H20N4OS
Molecular Weight292.41 g/mol
Exact Mass292.14
IUPAC Name2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one
SMILESCc1csc(C(C)NC(C)c2c(C)nc(C)[nH]c2=O)n1
InChIInChI=1S/C14H20N4OS/c1-7-6-20-14(15-7)10(4)16-8(2)12-9(3)17-11(5)18-13(12)19/h6,8,10,16H,1-5H3,(H,17,18,19)
InChIKeyBODPWYZRTYCXHD-UHFFFAOYSA-N
XLogP2.56
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.41
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one with MolForge

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Related Compounds

2-[1-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)ethylamino]-N-ethyl-N-methylpropanamide
CID 136713555
2-methyl-3-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]-3-oxopropanoic acid
CID 114898569
2,4-dimethyl-5-[1-[1-(2-oxopyrrolidin-1-yl)propan-2-ylamino]ethyl]-1H-pyrimidin-6-one
CID 135968751
6-amino-1-methyl-5-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pyrimidine-2,4-dione
CID 63091923
1-(2,5-dichlorothiophen-3-yl)-N-[1-(4-methyl-1,3-thiazol-2-yl)ethyl]ethanamine
CID 113261082
N-[(2-methyl-1H-imidazol-5-yl)methyl]-1-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 63091931
2,4-dimethyl-5-[1-[2-(2-methylpropoxy)ethylamino]ethyl]-1H-pyrimidin-6-one
CID 136931872
2,4-dimethyl-5-[1-(4,4,4-trifluorobutylamino)ethyl]-1H-pyrimidin-6-one
CID 136952773
N'-hydroxy-3-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]butanimidamide
CID 77045213
5-[1-[[1-hydroxy-2-(hydroxymethyl)butan-2-yl]amino]ethyl]-2,4-dimethyl-1H-pyrimidin-6-one
CID 136871924
2-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]pentanoic acid
CID 83041636
N-(2-methylsulfanylethyl)-1-(4-methyl-1,3-thiazol-2-yl)ethanamine
CID 104579189

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one?
The IUPAC name of 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one (CID 135992610) is 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one.
What is the SMILES notation for 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one?
The canonical SMILES for 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one is Cc1csc(C(C)NC(C)c2c(C)nc(C)[nH]c2=O)n1.
What is the InChIKey of 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one?
The InChIKey is BODPWYZRTYCXHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4OS/c1-7-6-20-14(15-7)10(4)16-8(2)12-9(3)17-11(5)18-13(12)19/h6,8,10,16H,1-5H3,(H,17,18,19).
What are the key properties of 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one?
2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one has a molecular weight of 292.41 g/mol, XLogP of 2.56, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-5-[1-[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]ethyl]-1H-pyrimidin-6-one is sourced from PubChem (CID 135992610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).