(4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone

C18H19FO — CID 143060614

IUPAC(4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone
SMILESCCCc1cc(C(=O)c2ccc(F)cc2)ccc1CC
InChIInChI=1S/C18H19FO/c1-3-5-15-12-16(7-6-13(15)4-2)18(20)14-8-10-17(19)11-9-14/h6-12H,3-5H2,1-2H3
InChIKeyKYDZQBFJVBDURX-UHFFFAOYSA-N
MW270.35 g/mol
LogP4.57
Rot. Bonds5

About (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone

(4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone (PubChem CID 143060614) has the molecular formula C18H19FO and a molecular weight of 270.35 g/mol. Its IUPAC name is (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone.

Molecular Properties

Compound Name(4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone
PubChem CID143060614
Molecular FormulaC18H19FO
Molecular Weight270.35 g/mol
Exact Mass270.14
IUPAC Name(4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone
SMILESCCCc1cc(C(=O)c2ccc(F)cc2)ccc1CC
InChIInChI=1S/C18H19FO/c1-3-5-15-12-16(7-6-13(15)4-2)18(20)14-8-10-17(19)11-9-14/h6-12H,3-5H2,1-2H3
InChIKeyKYDZQBFJVBDURX-UHFFFAOYSA-N
XLogP4.57
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-3-propylbenzoic acid
CID 11745258
(3,5-dimethylphenyl)-(4-fluorophenyl)methanone
CID 43159976
ethane;5-fluoro-2-propylphenol
CID 143012210
(4-chloro-3-fluorophenyl)-(4-propylphenyl)methanone
CID 107996346
(4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone
CID 166044935
(2-chloro-6-fluorophenyl)-(3,4-diethylphenyl)methanone
CID 115481855
[3-[3-(4-fluorobenzoyl)phenyl]phenyl]-(4-fluorophenyl)methanone
CID 71341049
(3-bromo-4-methylphenyl)-(4-fluorophenyl)methanone
CID 79020160
4-(4-fluorophenyl)-2-propylphenol
CID 22458869
(4-fluorophenyl)-phenylmethanone
CID 161464622
4-chloro-1-ethyl-2-propylbenzene
CID 144500548
(4-fluorophenyl)-[2-(hydroxymethyl)-4-methylphenyl]methanone
CID 20687997

Frequently Asked Questions

What is the IUPAC name of (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone?
The IUPAC name of (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone (CID 143060614) is (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone.
What is the SMILES notation for (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone?
The canonical SMILES for (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone is CCCc1cc(C(=O)c2ccc(F)cc2)ccc1CC.
What is the InChIKey of (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone?
The InChIKey is KYDZQBFJVBDURX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FO/c1-3-5-15-12-16(7-6-13(15)4-2)18(20)14-8-10-17(19)11-9-14/h6-12H,3-5H2,1-2H3.
What are the key properties of (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone?
(4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone has a molecular weight of 270.35 g/mol, XLogP of 4.57, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethyl-3-propylphenyl)-(4-fluorophenyl)methanone is sourced from PubChem (CID 143060614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).