(2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone

C19H20O2 — CID 106790265

IUPAC(2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone
SMILESCOc1cc(C)ccc1C(=O)c1ccccc1C1CCC1
InChIInChI=1S/C19H20O2/c1-13-10-11-17(18(12-13)21-2)19(20)16-9-4-3-8-15(16)14-6-5-7-14/h3-4,8-12,14H,5-7H2,1-2H3
InChIKeyGUCKRNRDDQAZAI-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.50
Rot. Bonds4

About (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone

(2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone (PubChem CID 106790265) has the molecular formula C19H20O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone.

Molecular Properties

Compound Name(2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone
PubChem CID106790265
Molecular FormulaC19H20O2
Molecular Weight280.37 g/mol
Exact Mass280.15
IUPAC Name(2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone
SMILESCOc1cc(C)ccc1C(=O)c1ccccc1C1CCC1
InChIInChI=1S/C19H20O2/c1-13-10-11-17(18(12-13)21-2)19(20)16-9-4-3-8-15(16)14-6-5-7-14/h3-4,8-12,14H,5-7H2,1-2H3
InChIKeyGUCKRNRDDQAZAI-UHFFFAOYSA-N
XLogP4.50
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-cyclohexylphenyl)-(2-methylphenyl)methanone
CID 86030332
(2-cyclobutylphenyl)-(4-methoxyphenyl)methanone
CID 114601682
2-(2-methoxy-4-methylbenzoyl)-6-methylbenzoic acid
CID 166151352
(2-methoxy-4-methylphenyl)-(2-propoxyphenyl)methanone
CID 106790144
(2-cyclopentylphenyl)-(3-methoxyphenyl)methanone
CID 67555380
2-(2-cyclobutylphenyl)-4-methylbenzoic acid
CID 114605088
(2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanamine
CID 106791150
(2-cyclobutylphenyl)-(3,5-dimethyl-2-pyridinyl)methanone
CID 114602090
(2-chloro-4-fluorophenyl)-(2-cyclobutylphenyl)methanone
CID 114601820
(2-cyclobutylphenyl)-(3,4,5-trifluorophenyl)methanone
CID 114601779
(2-cyclobutylphenyl)-pyrimidin-2-ylmethanone
CID 114601750
(2-cyclohexylphenyl)-phenylmethanone
CID 22506424

Frequently Asked Questions

What is the IUPAC name of (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone?
The IUPAC name of (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone (CID 106790265) is (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone.
What is the SMILES notation for (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone?
The canonical SMILES for (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone is COc1cc(C)ccc1C(=O)c1ccccc1C1CCC1.
What is the InChIKey of (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone?
The InChIKey is GUCKRNRDDQAZAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O2/c1-13-10-11-17(18(12-13)21-2)19(20)16-9-4-3-8-15(16)14-6-5-7-14/h3-4,8-12,14H,5-7H2,1-2H3.
What are the key properties of (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone?
(2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone has a molecular weight of 280.37 g/mol, XLogP of 4.50, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclobutylphenyl)-(2-methoxy-4-methylphenyl)methanone is sourced from PubChem (CID 106790265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).