N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine

C20H14Cl2N4O — CID 71274367

IUPACN-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
SMILESCOc1ccc2nc(-c3cccnc3)nc(Nc3c(Cl)cccc3Cl)c2c1
InChIInChI=1S/C20H14Cl2N4O/c1-27-13-7-8-17-14(10-13)20(25-18-15(21)5-2-6-16(18)22)26-19(24-17)12-4-3-9-23-11-12/h2-11H,1H3,(H,24,25,26)
InChIKeyUBUKUOYJSHSBOJ-UHFFFAOYSA-N
MW397.27 g/mol
LogP5.75
Rot. Bonds4

About N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine

N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine (PubChem CID 71274367) has the molecular formula C20H14Cl2N4O and a molecular weight of 397.27 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
PubChem CID71274367
Molecular FormulaC20H14Cl2N4O
Molecular Weight397.27 g/mol
Exact Mass396.05
IUPAC NameN-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
SMILESCOc1ccc2nc(-c3cccnc3)nc(Nc3c(Cl)cccc3Cl)c2c1
InChIInChI=1S/C20H14Cl2N4O/c1-27-13-7-8-17-14(10-13)20(25-18-15(21)5-2-6-16(18)22)26-19(24-17)12-4-3-9-23-11-12/h2-11H,1H3,(H,24,25,26)
InChIKeyUBUKUOYJSHSBOJ-UHFFFAOYSA-N
XLogP5.75
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500397.27
LogP ≤ 55.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-chloro-3-methylphenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 71274391
6-methoxy-2-pyridin-3-yl-N-quinolin-8-ylquinazolin-4-amine
CID 71274409
6-methoxy-N-[5-(3-methoxyphenyl)-1H-pyrazol-3-yl]-2-pyridin-3-ylquinazolin-4-amine
CID 71180169
N-(2-fluorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 67298112
N-[5-(3,5-dichlorophenyl)-1H-pyrazol-3-yl]-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 71273676
6-methoxy-2-pyridin-3-yl-N-quinolin-6-ylquinazolin-4-amine
CID 71274406
6-methoxy-N-[3-(1,3-oxazol-2-yl)phenyl]-2-pyridin-3-ylquinazolin-4-amine
CID 71180917
6-methoxy-N-(1-methylindol-2-yl)-2-pyridin-3-ylquinazolin-4-amine
CID 71181123
2-methoxy-N-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-1,3-benzoxazol-6-amine
CID 71180927
N-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-1,3-benzothiazol-6-amine
CID 71273583
N-(2,2-difluoro-1,3-benzodioxol-4-yl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine
CID 71180386
4-(4-fluorophenyl)-N-(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)-1,3-thiazol-2-amine
CID 89347866

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine?
The IUPAC name of N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine (CID 71274367) is N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine.
What is the SMILES notation for N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine?
The canonical SMILES for N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine is COc1ccc2nc(-c3cccnc3)nc(Nc3c(Cl)cccc3Cl)c2c1.
What is the InChIKey of N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine?
The InChIKey is UBUKUOYJSHSBOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2N4O/c1-27-13-7-8-17-14(10-13)20(25-18-15(21)5-2-6-16(18)22)26-19(24-17)12-4-3-9-23-11-12/h2-11H,1H3,(H,24,25,26).
What are the key properties of N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine?
N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine has a molecular weight of 397.27 g/mol, XLogP of 5.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine is sourced from PubChem (CID 71274367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).