4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline

C22H15FN4O — CID 71273721

IUPAC4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline
SMILESCOc1ccc2nc(-c3cccnc3)nc(-n3ccc4cc(F)ccc43)c2c1
InChIInChI=1S/C22H15FN4O/c1-28-17-5-6-19-18(12-17)22(26-21(25-19)15-3-2-9-24-13-15)27-10-8-14-11-16(23)4-7-20(14)27/h2-13H,1H3
InChIKeyYZKNMBIRXJECME-UHFFFAOYSA-N
MW370.39 g/mol
LogP4.78
Rot. Bonds3

About 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline

4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline (PubChem CID 71273721) has the molecular formula C22H15FN4O and a molecular weight of 370.39 g/mol. Its IUPAC name is 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline.

Molecular Properties

Compound Name4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline
PubChem CID71273721
Molecular FormulaC22H15FN4O
Molecular Weight370.39 g/mol
Exact Mass370.12
IUPAC Name4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline
SMILESCOc1ccc2nc(-c3cccnc3)nc(-n3ccc4cc(F)ccc43)c2c1
InChIInChI=1S/C22H15FN4O/c1-28-17-5-6-19-18(12-17)22(26-21(25-19)15-3-2-9-24-13-15)27-10-8-14-11-16(23)4-7-20(14)27/h2-13H,1H3
InChIKeyYZKNMBIRXJECME-UHFFFAOYSA-N
XLogP4.78
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.39
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-methoxy-N-(1-methylindol-2-yl)-2-pyridin-3-ylquinazolin-4-amine
CID 71181123
N-(2-fluorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 67298112
4-(4-fluorophenyl)-N-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-1,3-thiazol-2-amine
CID 89347866
4-(3,5-difluorophenyl)-N-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-1,3-thiazol-2-amine
CID 89348061
4-(5-fluorobenzimidazol-1-yl)-6-propyl-2-pyridin-3-ylquinazoline
CID 123494448
6-(3-methoxyphenyl)-2-pyridin-3-yl-4-pyrrolidin-1-ylquinazoline
CID 141404533
6-(3-methoxyphenyl)-4-piperidin-1-yl-2-pyridin-3-ylquinazoline
CID 71181032
4-(5,6-dichlorobenzimidazol-1-yl)-6-ethoxy-2-pyridin-3-ylquinazoline
CID 71180055
N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 71274367
1-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-N,N-dimethyl-2,3-dihydroindol-5-amine
CID 71180671
6-(3-fluoro-5-methoxyphenyl)-N-methyl-2-pyridin-3-ylquinazolin-4-amine
CID 71179890
6-methoxy-2-pyridin-3-yl-N-quinolin-6-ylquinazolin-4-amine
CID 71274406

Frequently Asked Questions

What is the IUPAC name of 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline?
The IUPAC name of 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline (CID 71273721) is 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline.
What is the SMILES notation for 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline?
The canonical SMILES for 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline is COc1ccc2nc(-c3cccnc3)nc(-n3ccc4cc(F)ccc43)c2c1.
What is the InChIKey of 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline?
The InChIKey is YZKNMBIRXJECME-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN4O/c1-28-17-5-6-19-18(12-17)22(26-21(25-19)15-3-2-9-24-13-15)27-10-8-14-11-16(23)4-7-20(14)27/h2-13H,1H3.
What are the key properties of 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline?
4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline has a molecular weight of 370.39 g/mol, XLogP of 4.78, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-fluoroindol-1-yl)-6-methoxy-2-pyridin-3-ylquinazoline is sourced from PubChem (CID 71273721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).