2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine

C9H7ClN4O — CID 104516547

IUPAC2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine
SMILESCOc1nccnc1-c1cc(Cl)ncn1
InChIInChI=1S/C9H7ClN4O/c1-15-9-8(11-2-3-12-9)6-4-7(10)14-5-13-6/h2-5H,1H3
InChIKeyNYXMADRDKUHDSO-UHFFFAOYSA-N
MW222.64 g/mol
LogP1.60
Rot. Bonds2

About 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine

2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine (PubChem CID 104516547) has the molecular formula C9H7ClN4O and a molecular weight of 222.64 g/mol. Its IUPAC name is 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine.

Molecular Properties

Compound Name2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine
PubChem CID104516547
Molecular FormulaC9H7ClN4O
Molecular Weight222.64 g/mol
Exact Mass222.03
IUPAC Name2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine
SMILESCOc1nccnc1-c1cc(Cl)ncn1
InChIInChI=1S/C9H7ClN4O/c1-15-9-8(11-2-3-12-9)6-4-7(10)14-5-13-6/h2-5H,1H3
InChIKeyNYXMADRDKUHDSO-UHFFFAOYSA-N
XLogP1.60
TPSA60.79 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.64
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-chloro-6-(3-methoxypyrazin-2-yl)-2-(trifluoromethyl)pyrimidine
CID 106769030
4-chloro-6-(4-methoxyphenyl)pyrimidine
CID 11160353
2-methoxy-3-pyridin-2-ylpyrazine
CID 91147636
2-(5-chloropyrimidin-4-yl)-3-methoxypyrazine
CID 105371526
4-chloro-2-(3-methoxypyrazin-2-yl)-1,3-thiazole
CID 104516513
2-chloro-4-methoxy-6-(3-methoxypyrazin-2-yl)-1,3,5-triazine
CID 104516518
6-(3-methoxypyrazin-2-yl)pyridin-2-amine
CID 104516152
2-tert-butyl-6-(3-methoxypyrazin-2-yl)-N-methylpyrimidin-4-amine
CID 104516561
1-[4-(6-chloropyrimidin-4-yl)-1,3-oxazol-5-yl]ethanamine
CID 168932700
4-chloro-3-(3-methoxypyrazin-2-yl)benzoic acid
CID 107989853
1-[4-(6-chloropyrimidin-4-yl)-1,3-oxazol-5-yl]ethanone
CID 168932695
3-(6-chloropyrimidin-4-yl)-5-ethoxybenzonitrile
CID 121356395

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine?
The IUPAC name of 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine (CID 104516547) is 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine.
What is the SMILES notation for 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine?
The canonical SMILES for 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine is COc1nccnc1-c1cc(Cl)ncn1.
What is the InChIKey of 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine?
The InChIKey is NYXMADRDKUHDSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN4O/c1-15-9-8(11-2-3-12-9)6-4-7(10)14-5-13-6/h2-5H,1H3.
What are the key properties of 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine?
2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine has a molecular weight of 222.64 g/mol, XLogP of 1.60, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloropyrimidin-4-yl)-3-methoxypyrazine is sourced from PubChem (CID 104516547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).