4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline

C21H17N3O — CID 67700753

IUPAC4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline
SMILESCOc1ccccc1-c1nc(-c2cccc(C)n2)nc2ccccc12
InChIInChI=1S/C21H17N3O/c1-14-8-7-12-18(22-14)21-23-17-11-5-3-9-15(17)20(24-21)16-10-4-6-13-19(16)25-2/h3-13H,1-2H3
InChIKeyOULHNLHXRCJBNF-UHFFFAOYSA-N
MW327.39 g/mol
LogP4.68
Rot. Bonds3

About 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline

4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline (PubChem CID 67700753) has the molecular formula C21H17N3O and a molecular weight of 327.39 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline
PubChem CID67700753
Molecular FormulaC21H17N3O
Molecular Weight327.39 g/mol
Exact Mass327.14
IUPAC Name4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline
SMILESCOc1ccccc1-c1nc(-c2cccc(C)n2)nc2ccccc12
InChIInChI=1S/C21H17N3O/c1-14-8-7-12-18(22-14)21-23-17-11-5-3-9-15(17)20(24-21)16-10-4-6-13-19(16)25-2/h3-13H,1-2H3
InChIKeyOULHNLHXRCJBNF-UHFFFAOYSA-N
XLogP4.68
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Verubulin
CID 11414799
5-{[1-(2-Fluorobenzyl)piperidin-4-yl]methoxy}quinazoline-2,4-diamine
CID 23729147
CP-31398
CID 9950868
2,4-Quinazolinediamine, 5-methoxy-
CID 213752
5-(2-Fluorobenzyloxy)quinazoline-2,4-diamine
CID 24778025
7-(2-Methoxyphenyl)quinazoline-2,4-Diamine
CID 53346505
N-(4-methoxyphenyl)-2-pyridin-4-ylquinazolin-4-amine
CID 877998
2,4-Quinazolinediamine, 5-ethoxy-
CID 461900
N-(3-methoxyphenyl)quinazolin-4-amine
CID 712193
5-(4-Fluorophenoxy)quinazoline-2,4-diamine
CID 2824486
5-[(4-Methylbenzyl)oxy]quinazoline-2,4-diamine
CID 2824489
2-(7-Methoxy-4-methylquinazolin-2-yl)guanidine
CID 2835211

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline?
The IUPAC name of 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline (CID 67700753) is 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline.
What is the SMILES notation for 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline?
The canonical SMILES for 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline is COc1ccccc1-c1nc(-c2cccc(C)n2)nc2ccccc12.
What is the InChIKey of 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline?
The InChIKey is OULHNLHXRCJBNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O/c1-14-8-7-12-18(22-14)21-23-17-11-5-3-9-15(17)20(24-21)16-10-4-6-13-19(16)25-2/h3-13H,1-2H3.
What are the key properties of 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline?
4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline has a molecular weight of 327.39 g/mol, XLogP of 4.68, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-2-(6-methyl-2-pyridinyl)quinazoline is sourced from PubChem (CID 67700753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).