(4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone

C23H22O2 — CID 166044935

IUPAC(4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone
SMILESCCCc1cc(C(=O)c2ccc(-c3ccccc3)cc2)ccc1OC
InChIInChI=1S/C23H22O2/c1-3-7-20-16-21(14-15-22(20)25-2)23(24)19-12-10-18(11-13-19)17-8-5-4-6-9-17/h4-6,8-16H,3,7H2,1-2H3
InChIKeyVXENXRMRCGJLDR-UHFFFAOYSA-N
MW330.43 g/mol
LogP5.55
Rot. Bonds6

About (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone

(4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone (PubChem CID 166044935) has the molecular formula C23H22O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone.

Molecular Properties

Compound Name(4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone
PubChem CID166044935
Molecular FormulaC23H22O2
Molecular Weight330.43 g/mol
Exact Mass330.16
IUPAC Name(4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone
SMILESCCCc1cc(C(=O)c2ccc(-c3ccccc3)cc2)ccc1OC
InChIInChI=1S/C23H22O2/c1-3-7-20-16-21(14-15-22(20)25-2)23(24)19-12-10-18(11-13-19)17-8-5-4-6-9-17/h4-6,8-16H,3,7H2,1-2H3
InChIKeyVXENXRMRCGJLDR-UHFFFAOYSA-N
XLogP5.55
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.43
LogP ≤ 55.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chlorophenyl)-(4-methoxy-3-propylphenyl)methanone
CID 166082039
(3-fluoro-4-methoxyphenyl)-(4-phenylphenyl)methanone
CID 146005301
2-(2-methoxy-4-phenylphenyl)acetic acid
CID 23503476
[3-(4-phenylbenzoyl)phenyl]-(4-phenylphenyl)methanone
CID 19009361
3-(4-methoxy-3-propylphenyl)-2-methylpropanoic acid
CID 70957387
(2S)-2-hydroxy-2-[3-[4-(4-methoxybenzoyl)-2-propylphenoxy]phenyl]propanamide
CID 68684060
phenyl-(4-phenylphenyl)methanone
CID 155775877
2-ethoxy-2-[2-methanimidoyl-4-[3-[4-(4-phenylbenzoyl)-2-propylphenoxy]propoxy]anilino]acetic acid
CID 166082031
ethyl 3-[3-(3-ethoxy-3-oxopropyl)-4-methoxybenzoyl]benzoate
CID 14739655
(4-methoxyphenyl)-[4-(4-phenylphenoxy)phenyl]methanone
CID 146206951
[2-oxo-2-(4-phenylphenyl)ethyl] 4-butoxy-3-methoxybenzoate
CID 5183525
(2-fluoro-6-methoxyphenyl)-(4-phenylphenyl)methanone
CID 146005289

Frequently Asked Questions

What is the IUPAC name of (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone?
The IUPAC name of (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone (CID 166044935) is (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone.
What is the SMILES notation for (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone?
The canonical SMILES for (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone is CCCc1cc(C(=O)c2ccc(-c3ccccc3)cc2)ccc1OC.
What is the InChIKey of (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone?
The InChIKey is VXENXRMRCGJLDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22O2/c1-3-7-20-16-21(14-15-22(20)25-2)23(24)19-12-10-18(11-13-19)17-8-5-4-6-9-17/h4-6,8-16H,3,7H2,1-2H3.
What are the key properties of (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone?
(4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone has a molecular weight of 330.43 g/mol, XLogP of 5.55, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxy-3-propylphenyl)-(4-phenylphenyl)methanone is sourced from PubChem (CID 166044935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).