4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline

C19H18FNO — CID 156880047

IUPAC4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline
SMILESCOc1ccc2c(-c3ccc(F)cc3)c(C(C)C)cnc2c1
InChIInChI=1S/C19H18FNO/c1-12(2)17-11-21-18-10-15(22-3)8-9-16(18)19(17)13-4-6-14(20)7-5-13/h4-12H,1-3H3
InChIKeyAUZOAEOWTAIFCH-UHFFFAOYSA-N
MW295.36 g/mol
LogP5.17
Rot. Bonds3

About 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline

4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline (PubChem CID 156880047) has the molecular formula C19H18FNO and a molecular weight of 295.36 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline.

Molecular Properties

Compound Name4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline
PubChem CID156880047
Molecular FormulaC19H18FNO
Molecular Weight295.36 g/mol
Exact Mass295.14
IUPAC Name4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline
SMILESCOc1ccc2c(-c3ccc(F)cc3)c(C(C)C)cnc2c1
InChIInChI=1S/C19H18FNO/c1-12(2)17-11-21-18-10-15(22-3)8-9-16(18)19(17)13-4-6-14(20)7-5-13/h4-12H,1-3H3
InChIKeyAUZOAEOWTAIFCH-UHFFFAOYSA-N
XLogP5.17
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.36
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(3,5-dimethoxyphenyl)-3-(4-fluorophenyl)-2-methyl-5-propan-2-ylpyridine
CID 67076023
7-fluoro-4-(4-fluorophenyl)-3-propan-2-ylquinoline-6-carbaldehyde
CID 156879611
S-[[4-(3-fluoro-7-methoxyquinolin-4-yl)phenyl]methylamino]thiohydroxylamine
CID 142539954
6-fluoro-4-(4-methoxyphenyl)-3-methylquinoline
CID 122371652
7-methoxy-4-propan-2-ylcinnoline
CID 164758055
4-(4-fluoroanilino)-7-methoxyquinoline-3-carbonitrile
CID 50768736
7-fluoro-4-(4-methoxyphenyl)quinazoline
CID 132520825
6-(4-fluorophenyl)-2-[2-(7-methoxyquinolin-4-yl)oxyethyl]pyridazin-3-one
CID 25019685
N-(4-fluorophenyl)-7-methoxy-N-[1-(6-methoxy-3-pyridinyl)ethyl]quinazolin-4-amine
CID 162768168
3-(4-fluorophenyl)-6-methoxy-2-(4-methoxyphenoxy)-1-benzothiophene
CID 90111334
7-fluoro-4-(4-fluorophenyl)-1-phenyl-2-propan-2-ylnaphthalene
CID 71425194
2-(4-fluorophenyl)-7-methoxychromene-4-thione
CID 46232007

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline?
The IUPAC name of 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline (CID 156880047) is 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline.
What is the SMILES notation for 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline?
The canonical SMILES for 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline is COc1ccc2c(-c3ccc(F)cc3)c(C(C)C)cnc2c1.
What is the InChIKey of 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline?
The InChIKey is AUZOAEOWTAIFCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FNO/c1-12(2)17-11-21-18-10-15(22-3)8-9-16(18)19(17)13-4-6-14(20)7-5-13/h4-12H,1-3H3.
What are the key properties of 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline?
4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline has a molecular weight of 295.36 g/mol, XLogP of 5.17, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-7-methoxy-3-propan-2-ylquinoline is sourced from PubChem (CID 156880047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).