2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline

C15H10ClFN2O — CID 122648777

IUPAC2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline
SMILESCOc1cc(F)ccc1-c1cccc2cnc(Cl)nc12
InChIInChI=1S/C15H10ClFN2O/c1-20-13-7-10(17)5-6-11(13)12-4-2-3-9-8-18-15(16)19-14(9)12/h2-8H,1H3
InChIKeySRVPXUICRUHXHS-UHFFFAOYSA-N
MW288.71 g/mol
LogP4.10
Rot. Bonds2

About 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline

2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline (PubChem CID 122648777) has the molecular formula C15H10ClFN2O and a molecular weight of 288.71 g/mol. Its IUPAC name is 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline.

Molecular Properties

Compound Name2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline
PubChem CID122648777
Molecular FormulaC15H10ClFN2O
Molecular Weight288.71 g/mol
Exact Mass288.05
IUPAC Name2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline
SMILESCOc1cc(F)ccc1-c1cccc2cnc(Cl)nc12
InChIInChI=1S/C15H10ClFN2O/c1-20-13-7-10(17)5-6-11(13)12-4-2-3-9-8-18-15(16)19-14(9)12/h2-8H,1H3
InChIKeySRVPXUICRUHXHS-UHFFFAOYSA-N
XLogP4.10
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.71
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-4-(4-fluoro-2-methoxyphenyl)pyrimidine
CID 24901904
N-(3-cyclohexyl-1-propan-2-ylpyrazol-5-yl)-8-(4-fluoro-2-methoxyphenyl)quinazolin-2-amine
CID 159319999
2-chloro-N-(4-fluoro-2-methoxyphenyl)-5-methylpyrimidin-4-amine
CID 79073354
2-chloro-8-methylquinazoline
CID 53416811
[2-chloro-4-(4-fluoro-2-methoxyphenyl)-3-pyridinyl]methanamine
CID 88879811
2-(4-fluoro-2-methoxyphenyl)-7-methylcyclohepta-2,4,6-trien-1-one
CID 118330524
4-(4-fluoro-2-methoxyphenyl)-N-methylpyridin-3-amine
CID 70663207
2-chloro-N-(4-fluoro-2-methylphenyl)-5-methoxypyrimidin-4-amine
CID 144841186
2,3-difluoro-1,4-bis(2-methoxyphenyl)benzene
CID 58004087
4-(4-fluoro-2-methoxyphenyl)-1,2-oxazol-5-amine
CID 117297113
4-(4-fluoro-2-methoxyphenyl)-1H-pyrazol-5-amine
CID 117295551
tert-butyl N-[3-[5-[[8-(4-fluoro-2-methoxyphenyl)quinazolin-2-yl]amino]-1-propan-2-ylpyrazol-3-yl]pentyl]carbamate
CID 122648882

Frequently Asked Questions

What is the IUPAC name of 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline?
The IUPAC name of 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline (CID 122648777) is 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline.
What is the SMILES notation for 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline?
The canonical SMILES for 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline is COc1cc(F)ccc1-c1cccc2cnc(Cl)nc12.
What is the InChIKey of 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline?
The InChIKey is SRVPXUICRUHXHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFN2O/c1-20-13-7-10(17)5-6-11(13)12-4-2-3-9-8-18-15(16)19-14(9)12/h2-8H,1H3.
What are the key properties of 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline?
2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline has a molecular weight of 288.71 g/mol, XLogP of 4.10, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-8-(4-fluoro-2-methoxyphenyl)quinazoline is sourced from PubChem (CID 122648777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).