(3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone

C19H22O2 — CID 63492313

IUPAC(3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2cccc(OC(C)C)c2)c(C)c1
InChIInChI=1S/C19H22O2/c1-12(2)21-17-8-6-7-16(11-17)19(20)18-14(4)9-13(3)10-15(18)5/h6-12H,1-5H3
InChIKeyRSYHSVLYDYDTTL-UHFFFAOYSA-N
MW282.38 g/mol
LogP4.63
Rot. Bonds4

About (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone

(3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone (PubChem CID 63492313) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Name(3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone
PubChem CID63492313
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name(3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone
SMILESCc1cc(C)c(C(=O)c2cccc(OC(C)C)c2)c(C)c1
InChIInChI=1S/C19H22O2/c1-12(2)21-17-8-6-7-16(11-17)19(20)18-14(4)9-13(3)10-15(18)5/h6-12H,1-5H3
InChIKeyRSYHSVLYDYDTTL-UHFFFAOYSA-N
XLogP4.63
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone
CID 43161494
(3,4-dimethylphenyl)-(3-propan-2-yloxyphenyl)methanone
CID 63491128
[3-(difluoromethoxy)phenyl]-(2-fluoro-4,6-dimethylphenyl)methanone
CID 106883266
(5-bromo-4-methylthiophen-2-yl)-(3-propan-2-yloxyphenyl)methanone
CID 79996537
furan-2-yl-(3-propan-2-yloxyphenyl)methanone
CID 62919464
N-propan-2-yl-3-propan-2-yloxybenzamide
CID 8779048
ethane;phenyl-(2,4,6-trimethylphenyl)methanone
CID 90795600
1-methyl-4-(3-propan-2-yloxybenzoyl)pyrrole-2-carboxylic acid
CID 62921507
[3,5-di(propan-2-yloxy)phenyl]-phenylmethanone
CID 67418850
sodium (4-methoxyphenyl) [3-(2,4,6-trimethylbenzoyl)phenyl] phosphate
CID 23708345
(3-ethoxyphenyl)-(4-propan-2-yloxyphenyl)methanone
CID 62797135
(2,4-dibromophenyl)-(3-propan-2-yloxyphenyl)methanone
CID 107944669

Frequently Asked Questions

What is the IUPAC name of (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone (CID 63492313) is (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone is Cc1cc(C)c(C(=O)c2cccc(OC(C)C)c2)c(C)c1.
What is the InChIKey of (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone?
The InChIKey is RSYHSVLYDYDTTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-12(2)21-17-8-6-7-16(11-17)19(20)18-14(4)9-13(3)10-15(18)5/h6-12H,1-5H3.
What are the key properties of (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone?
(3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone has a molecular weight of 282.38 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-propan-2-yloxyphenyl)-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 63492313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).