N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide

C8H10ClN3O2 — CID 11344949

IUPACN-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide
SMILESCOc1nc(C)c(NC(C)=O)c(Cl)n1
InChIInChI=1S/C8H10ClN3O2/c1-4-6(11-5(2)13)7(9)12-8(10-4)14-3/h1-3H3,(H,11,13)
InChIKeyGJHYPYZHKUBXTJ-UHFFFAOYSA-N
MW215.64 g/mol
LogP1.41
Rot. Bonds2

About N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide

N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide (PubChem CID 11344949) has the molecular formula C8H10ClN3O2 and a molecular weight of 215.64 g/mol. Its IUPAC name is N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide
PubChem CID11344949
Molecular FormulaC8H10ClN3O2
Molecular Weight215.64 g/mol
Exact Mass215.05
IUPAC NameN-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide
SMILESCOc1nc(C)c(NC(C)=O)c(Cl)n1
InChIInChI=1S/C8H10ClN3O2/c1-4-6(11-5(2)13)7(9)12-8(10-4)14-3/h1-3H3,(H,11,13)
InChIKeyGJHYPYZHKUBXTJ-UHFFFAOYSA-N
XLogP1.41
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.64
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide?
The IUPAC name of N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide (CID 11344949) is N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide.
What is the SMILES notation for N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide?
The canonical SMILES for N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide is COc1nc(C)c(NC(C)=O)c(Cl)n1.
What is the InChIKey of N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide?
The InChIKey is GJHYPYZHKUBXTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O2/c1-4-6(11-5(2)13)7(9)12-8(10-4)14-3/h1-3H3,(H,11,13).
What are the key properties of N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide?
N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide has a molecular weight of 215.64 g/mol, XLogP of 1.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methoxy-6-methylpyrimidin-5-yl)acetamide is sourced from PubChem (CID 11344949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).