4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine

C10H8Cl2N2OS — CID 107360954

IUPAC4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine
SMILESCOCc1nc(Cl)cc(-c2sccc2Cl)n1
InChIInChI=1S/C10H8Cl2N2OS/c1-15-5-9-13-7(4-8(12)14-9)10-6(11)2-3-16-10/h2-4H,5H2,1H3
InChIKeyKPKWSWLYPQPVTK-UHFFFAOYSA-N
MW275.16 g/mol
LogP3.66
Rot. Bonds3

About 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine

4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine (PubChem CID 107360954) has the molecular formula C10H8Cl2N2OS and a molecular weight of 275.16 g/mol. Its IUPAC name is 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine.

Molecular Properties

Compound Name4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine
PubChem CID107360954
Molecular FormulaC10H8Cl2N2OS
Molecular Weight275.16 g/mol
Exact Mass273.97
IUPAC Name4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine
SMILESCOCc1nc(Cl)cc(-c2sccc2Cl)n1
InChIInChI=1S/C10H8Cl2N2OS/c1-15-5-9-13-7(4-8(12)14-9)10-6(11)2-3-16-10/h2-4H,5H2,1H3
InChIKeyKPKWSWLYPQPVTK-UHFFFAOYSA-N
XLogP3.66
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.16
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dichloro-2-(3-chlorothiophen-2-yl)pyrimidine
CID 131008069
4-(3-bromo-2,4-dimethoxyphenyl)-6-chloro-2-(methoxymethyl)pyrimidine
CID 103523993
6-chloro-2-(methoxymethyl)-N-[2-(1,3-thiazol-2-yl)propan-2-yl]pyrimidin-4-amine
CID 114131055
6-chloro-2-(methoxymethyl)-N-[1-(1,3-thiazol-2-yl)ethyl]pyrimidin-4-amine
CID 113401003
4-chloro-6-[(3-chloro-2-pyridinyl)sulfanyl]-2-(methoxymethyl)pyrimidine
CID 113401115
4-chloro-6-(5-ethoxy-3-pyridinyl)-2-(methoxymethyl)pyrimidine
CID 113401167
4-chloro-6-(3,5-dichlorophenyl)sulfanyl-2-(methoxymethyl)pyrimidine
CID 112736303
4-chloro-2-(methoxymethyl)pyrimidine
CID 14306130
3-chloro-6-(3-chlorothiophen-2-yl)pyridazine
CID 107360927
6-chloro-N-(2-chloro-5-fluorophenyl)-2-(methoxymethyl)pyrimidin-4-amine
CID 107530548
6-chloro-N-cyclopentyl-2-(methoxymethyl)pyrimidin-4-amine
CID 82463145
6-(3-chlorothiophen-2-yl)-N-ethyl-2-methylpyrimidin-4-amine
CID 107361117

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine?
The IUPAC name of 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine (CID 107360954) is 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine.
What is the SMILES notation for 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine?
The canonical SMILES for 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine is COCc1nc(Cl)cc(-c2sccc2Cl)n1.
What is the InChIKey of 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine?
The InChIKey is KPKWSWLYPQPVTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2OS/c1-15-5-9-13-7(4-8(12)14-9)10-6(11)2-3-16-10/h2-4H,5H2,1H3.
What are the key properties of 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine?
4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine has a molecular weight of 275.16 g/mol, XLogP of 3.66, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(3-chlorothiophen-2-yl)-2-(methoxymethyl)pyrimidine is sourced from PubChem (CID 107360954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).