4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine

C10H8ClN3O — CID 105371014

IUPAC4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine
SMILESCOc1ccc(-c2cncnc2Cl)cn1
InChIInChI=1S/C10H8ClN3O/c1-15-9-3-2-7(4-13-9)8-5-12-6-14-10(8)11/h2-6H,1H3
InChIKeyWPROJEMQBJONOY-UHFFFAOYSA-N
MW221.65 g/mol
LogP2.20
Rot. Bonds2

About 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine

4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine (PubChem CID 105371014) has the molecular formula C10H8ClN3O and a molecular weight of 221.65 g/mol. Its IUPAC name is 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine.

Molecular Properties

Compound Name4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine
PubChem CID105371014
Molecular FormulaC10H8ClN3O
Molecular Weight221.65 g/mol
Exact Mass221.04
IUPAC Name4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine
SMILESCOc1ccc(-c2cncnc2Cl)cn1
InChIInChI=1S/C10H8ClN3O/c1-15-9-3-2-7(4-13-9)8-5-12-6-14-10(8)11/h2-6H,1H3
InChIKeyWPROJEMQBJONOY-UHFFFAOYSA-N
XLogP2.20
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.65
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-5-(3-fluoro-4-methoxyphenyl)pyrimidine
CID 105371106
5-(4-chlorophenyl)-2-methoxypyridine;ethane
CID 143906878
N,N-dichloro-4-(6-methoxy-3-pyridinyl)aniline
CID 141410973
2,6-difluoro-4-[4-(6-methoxy-3-pyridinyl)-3-pyridinyl]phenol
CID 122186030
6-(6-methoxy-3-pyridinyl)pyridin-3-ol
CID 83128352
[5-chloro-2-(6-methoxy-3-pyridinyl)phenyl]methanamine
CID 66159518
2-methoxy-5-(2-methyl-3-pyridinyl)pyridine
CID 90167711
3-methoxy-6-(6-methoxy-3-pyridinyl)pyridazine
CID 24851547
5-(4-iodophenyl)-2-methoxypyridine
CID 121329970
3,5-dichloro-4-(6-methoxy-3-pyridinyl)aniline
CID 90390971
6-chloro-3-(6-methoxy-3-pyridinyl)imidazo[1,2-b]pyridazine
CID 58857859
5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine
CID 79728874

Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine?
The IUPAC name of 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine (CID 105371014) is 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine.
What is the SMILES notation for 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine?
The canonical SMILES for 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine is COc1ccc(-c2cncnc2Cl)cn1.
What is the InChIKey of 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine?
The InChIKey is WPROJEMQBJONOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClN3O/c1-15-9-3-2-7(4-13-9)8-5-12-6-14-10(8)11/h2-6H,1H3.
What are the key properties of 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine?
4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine has a molecular weight of 221.65 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-(6-methoxy-3-pyridinyl)pyrimidine is sourced from PubChem (CID 105371014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).