6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine

C11H18ClN3O — CID 63728451

IUPAC6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine
SMILESCCN(CCOC)c1nc(C)nc(Cl)c1C
InChIInChI=1S/C11H18ClN3O/c1-5-15(6-7-16-4)11-8(2)10(12)13-9(3)14-11/h5-7H2,1-4H3
InChIKeyZETHEGZIQBHAEF-UHFFFAOYSA-N
MW243.74 g/mol
LogP2.22
Rot. Bonds5

About 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine

6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine (PubChem CID 63728451) has the molecular formula C11H18ClN3O and a molecular weight of 243.74 g/mol. Its IUPAC name is 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine
PubChem CID63728451
Molecular FormulaC11H18ClN3O
Molecular Weight243.74 g/mol
Exact Mass243.11
IUPAC Name6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine
SMILESCCN(CCOC)c1nc(C)nc(Cl)c1C
InChIInChI=1S/C11H18ClN3O/c1-5-15(6-7-16-4)11-8(2)10(12)13-9(3)14-11/h5-7H2,1-4H3
InChIKeyZETHEGZIQBHAEF-UHFFFAOYSA-N
XLogP2.22
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-ethyl-4-N-(2-methoxyethyl)-6-N,2,5-trimethylpyrimidine-4,6-diamine
CID 80808572
6-chloro-N-ethyl-5-fluoro-2-methyl-N-propylpyrimidin-4-amine
CID 165486456
N,2-diethyl-6-hydrazinyl-N-(2-methoxyethyl)-5-methylpyrimidin-4-amine
CID 80994825
6-chloro-4-N,4-N-diethyl-2-N,2-N-bis(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
CID 62863384
4-chloro-6-(2-methoxyethoxy)-2,5-dimethylpyrimidine
CID 63735529
1-[(6-chloro-2,5-dimethylpyrimidin-4-yl)-methylamino]-3-methoxypropan-2-ol
CID 63729834
3-[[2,5-dimethyl-6-(propylamino)pyrimidin-4-yl]-(2-methoxyethyl)amino]propanenitrile
CID 80814264
N-ethyl-6-hydrazinyl-N-(2-methoxyethyl)-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 80995028
6-chloro-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-methyl-2-propylpyrimidin-4-amine
CID 80979560
N-butan-2-yl-6-chloro-N-(2-methoxyethyl)-5-methyl-2-propylpyrimidin-4-amine
CID 80972379
N'-(6-chloro-2,5-dimethylpyrimidin-4-yl)-N,N,N'-trimethylethane-1,2-diamine
CID 63730048
6-chloro-2-[ethyl(2-methoxyethyl)amino]pyridine-3-carboxylic acid
CID 55183616

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine (CID 63728451) is 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine is CCN(CCOC)c1nc(C)nc(Cl)c1C.
What is the InChIKey of 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine?
The InChIKey is ZETHEGZIQBHAEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN3O/c1-5-15(6-7-16-4)11-8(2)10(12)13-9(3)14-11/h5-7H2,1-4H3.
What are the key properties of 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine?
6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine has a molecular weight of 243.74 g/mol, XLogP of 2.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-ethyl-N-(2-methoxyethyl)-2,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 63728451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).