2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline

C20H15N3O — CID 67688255

IUPAC2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline
SMILESCOc1cccc(-c2cccc(-c3ncc4ccccc4n3)n2)c1
InChIInChI=1S/C20H15N3O/c1-24-16-8-4-7-14(12-16)17-10-5-11-19(22-17)20-21-13-15-6-2-3-9-18(15)23-20/h2-13H,1H3
InChIKeyRYUXYBFXZUFJPH-UHFFFAOYSA-N
MW313.36 g/mol
LogP4.37
Rot. Bonds3

About 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline

2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline (PubChem CID 67688255) has the molecular formula C20H15N3O and a molecular weight of 313.36 g/mol. Its IUPAC name is 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline.

Molecular Properties

Compound Name2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline
PubChem CID67688255
Molecular FormulaC20H15N3O
Molecular Weight313.36 g/mol
Exact Mass313.12
IUPAC Name2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline
SMILESCOc1cccc(-c2cccc(-c3ncc4ccccc4n3)n2)c1
InChIInChI=1S/C20H15N3O/c1-24-16-8-4-7-14(12-16)17-10-5-11-19(22-17)20-21-13-15-6-2-3-9-18(15)23-20/h2-13H,1H3
InChIKeyRYUXYBFXZUFJPH-UHFFFAOYSA-N
XLogP4.37
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.36
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[6-(4-methoxyphenyl)-2-pyridinyl]quinazoline
CID 67688203
2-[6-(3-ethoxyphenyl)-2-pyridinyl]quinazoline
CID 67688216
2-[6-(3,4-dimethoxyphenyl)-2-pyridinyl]quinazoline
CID 67688331
2-[6-(3-ethoxyphenyl)-5-methyl-2-pyridinyl]quinazoline
CID 67688517
2-phenyl-9-quinazolin-2-yl-1,10-phenanthroline
CID 171732276
2-phenylquinazoline
CID 158733567
2-(3-methoxyphenyl)-5-methylpyrimidine
CID 121432653
3-bromo-2-(3-methoxyphenyl)quinoline
CID 71658570
4-(3-methoxyphenyl)-2-(6-propan-2-yl-2-pyridinyl)quinazoline
CID 67699971
ethyl 2-(3-methoxyphenyl)quinazoline-6-carboxylate
CID 139986038
6-bromo-2-(3-methoxyphenyl)quinoline
CID 53443478
3,4-bis(3-methoxyphenyl)isoquinoline
CID 177415076

Frequently Asked Questions

What is the IUPAC name of 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline?
The IUPAC name of 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline (CID 67688255) is 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline.
What is the SMILES notation for 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline?
The canonical SMILES for 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline is COc1cccc(-c2cccc(-c3ncc4ccccc4n3)n2)c1.
What is the InChIKey of 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline?
The InChIKey is RYUXYBFXZUFJPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O/c1-24-16-8-4-7-14(12-16)17-10-5-11-19(22-17)20-21-13-15-6-2-3-9-18(15)23-20/h2-13H,1H3.
What are the key properties of 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline?
2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline has a molecular weight of 313.36 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-(3-methoxyphenyl)-2-pyridinyl]quinazoline is sourced from PubChem (CID 67688255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).