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

C9H14ClN3O — CID 63728106

IUPAC6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine
SMILESCOCCN(C)c1ncnc(Cl)c1C
InChIInChI=1S/C9H14ClN3O/c1-7-8(10)11-6-12-9(7)13(2)4-5-14-3/h6H,4-5H2,1-3H3
InChIKeyIGRQGASCFMHWHJ-UHFFFAOYSA-N
MW215.68 g/mol
LogP1.52
Rot. Bonds4

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

6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine (PubChem CID 63728106) has the molecular formula C9H14ClN3O and a molecular weight of 215.68 g/mol. Its IUPAC name is 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine
PubChem CID63728106
Molecular FormulaC9H14ClN3O
Molecular Weight215.68 g/mol
Exact Mass215.08
IUPAC Name6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine
SMILESCOCCN(C)c1ncnc(Cl)c1C
InChIInChI=1S/C9H14ClN3O/c1-7-8(10)11-6-12-9(7)13(2)4-5-14-3/h6H,4-5H2,1-3H3
InChIKeyIGRQGASCFMHWHJ-UHFFFAOYSA-N
XLogP1.52
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.68
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-(2-methoxyethyl)-N-(1-methoxypropan-2-yl)-5-methylpyrimidin-4-amine
CID 63728317
6-chloro-N,5-dimethyl-N-(3-methylbutyl)pyrimidin-4-amine
CID 63727942
4-N-(3-methoxypropyl)-4-N,6-N,5-trimethylpyrimidine-4,6-diamine
CID 80823623
6-hydrazinyl-N-(3-methoxypropyl)-N,5-dimethylpyrimidin-4-amine
CID 80913732
4-N,4-N-bis(2-methoxyethyl)-6-N,5-dimethylpyrimidine-4,6-diamine
CID 80795868
6-chloro-4-N-methyl-4-N-(2-propan-2-yloxyethyl)pyrimidine-4,5-diamine
CID 81059374
6-chloro-N,5-dimethyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]pyrimidin-4-amine
CID 63838232
4-N-(2-methoxyethyl)-4-N-methyl-5-propylpyrimidine-4,6-diamine
CID 80795825
6-chloro-N,5-dimethyl-N-(1,3-thiazol-4-ylmethyl)pyrimidin-4-amine
CID 63728838
N-butan-2-yl-6-chloro-N,5-dimethylpyrimidin-4-amine
CID 63729764
6-chloro-N-(furan-3-ylmethyl)-N,5-dimethylpyrimidin-4-amine
CID 63729632
N'-(6-chloro-5-methylpyrimidin-4-yl)-N'-ethyl-N,N-dimethylpropane-1,3-diamine
CID 102995604

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine?
The IUPAC name of 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine (CID 63728106) is 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine.
What is the SMILES notation for 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine?
The canonical SMILES for 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine is COCCN(C)c1ncnc(Cl)c1C.
What is the InChIKey of 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine?
The InChIKey is IGRQGASCFMHWHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClN3O/c1-7-8(10)11-6-12-9(7)13(2)4-5-14-3/h6H,4-5H2,1-3H3.
What are the key properties of 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine?
6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine has a molecular weight of 215.68 g/mol, XLogP of 1.52, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-methoxyethyl)-N,5-dimethylpyrimidin-4-amine is sourced from PubChem (CID 63728106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).