2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide

C12H19ClN4O — CID 103103666

IUPAC2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide
SMILESCCCc1nc(Cl)c(C)c(N(CC)CC(N)=O)n1
InChIInChI=1S/C12H19ClN4O/c1-4-6-10-15-11(13)8(3)12(16-10)17(5-2)7-9(14)18/h4-7H2,1-3H3,(H2,14,18)
InChIKeyJGUDQLYFIRYUAU-UHFFFAOYSA-N
MW270.76 g/mol
LogP1.70
Rot. Bonds6

About 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide

2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide (PubChem CID 103103666) has the molecular formula C12H19ClN4O and a molecular weight of 270.76 g/mol. Its IUPAC name is 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide.

Molecular Properties

Compound Name2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide
PubChem CID103103666
Molecular FormulaC12H19ClN4O
Molecular Weight270.76 g/mol
Exact Mass270.12
IUPAC Name2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide
SMILESCCCc1nc(Cl)c(C)c(N(CC)CC(N)=O)n1
InChIInChI=1S/C12H19ClN4O/c1-4-6-10-15-11(13)8(3)12(16-10)17(5-2)7-9(14)18/h4-7H2,1-3H3,(H2,14,18)
InChIKeyJGUDQLYFIRYUAU-UHFFFAOYSA-N
XLogP1.70
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[butyl-(6-chloro-5-methyl-2-propylpyrimidin-4-yl)amino]acetamide
CID 80972549
2-[(6-chloro-5-methylpyrimidin-4-yl)-ethylamino]acetamide
CID 103103651
6-chloro-N-ethyl-N-(2-ethylbutyl)-5-methyl-2-propylpyrimidin-4-amine
CID 80970845
N'-(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-N'-ethyl-N,N-dimethylpropane-1,3-diamine
CID 102995620
2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-methylamino]-N-methylacetamide
CID 80970815
2-[butyl-(6-chloro-2-cyclopropyl-5-methylpyrimidin-4-yl)amino]acetamide
CID 80971414
2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-(2,2-difluoroethyl)amino]ethanol
CID 107482089
6-chloro-N-ethyl-5-methyl-2-propyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80969977
2-[(4,6-dichloro-1,3,5-triazin-2-yl)-ethylamino]acetamide
CID 103103709
6-chloro-N,5-dimethyl-N-(2-methylsulfonylethyl)-2-propylpyrimidin-4-amine
CID 80977700
2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-pentan-3-ylamino]ethanol
CID 80972297
2-[(2-amino-2-oxoethyl)-ethylamino]-6-chloropyridine-3-carboxylic acid
CID 103102785

Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide?
The IUPAC name of 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide (CID 103103666) is 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide.
What is the SMILES notation for 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide?
The canonical SMILES for 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide is CCCc1nc(Cl)c(C)c(N(CC)CC(N)=O)n1.
What is the InChIKey of 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide?
The InChIKey is JGUDQLYFIRYUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN4O/c1-4-6-10-15-11(13)8(3)12(16-10)17(5-2)7-9(14)18/h4-7H2,1-3H3,(H2,14,18).
What are the key properties of 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide?
2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide has a molecular weight of 270.76 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-chloro-5-methyl-2-propylpyrimidin-4-yl)-ethylamino]acetamide is sourced from PubChem (CID 103103666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).