(3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone

C19H20O2 — CID 114521063

IUPAC(3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone
SMILESCC(C)c1ccc(C(=O)c2cccc(OC3CC3)c2)cc1
InChIInChI=1S/C19H20O2/c1-13(2)14-6-8-15(9-7-14)19(20)16-4-3-5-18(12-16)21-17-10-11-17/h3-9,12-13,17H,10-11H2,1-2H3
InChIKeyDDBKKUNBSBDOHA-UHFFFAOYSA-N
MW280.37 g/mol
LogP4.58
Rot. Bonds5

About (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone

(3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone (PubChem CID 114521063) has the molecular formula C19H20O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone.

Molecular Properties

Compound Name(3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone
PubChem CID114521063
Molecular FormulaC19H20O2
Molecular Weight280.37 g/mol
Exact Mass280.15
IUPAC Name(3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone
SMILESCC(C)c1ccc(C(=O)c2cccc(OC3CC3)c2)cc1
InChIInChI=1S/C19H20O2/c1-13(2)14-6-8-15(9-7-14)19(20)16-4-3-5-18(12-16)21-17-10-11-17/h3-9,12-13,17H,10-11H2,1-2H3
InChIKeyDDBKKUNBSBDOHA-UHFFFAOYSA-N
XLogP4.58
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

[4-(aminomethyl)phenyl]-(3-cyclopropyloxyphenyl)methanone
CID 114523660
(3-cyclopropyloxyphenyl)-(6-methyl-3-pyridinyl)methanone
CID 105134421
[4-(2-aminoethyl)phenyl]-(3-cyclopropyloxyphenyl)methanone
CID 114523778
(3-propan-2-ylphenyl)-(4-propan-2-ylphenyl)methanone
CID 170780602
(3-cyclopropyloxyphenyl)-(4-propan-2-ylthiadiazol-5-yl)methanone
CID 105134513
1-(3-cyclopropyloxyphenyl)-2-(methylamino)propan-1-one
CID 114523725
1-(3-cyclopropyloxyphenyl)-2-methylbutan-1-one
CID 114521136
(5-chloro-2-methylphenyl)-(3-cyclopropyloxyphenyl)methanone
CID 115813157
1-(3-cyclopropyloxyphenyl)propan-1-one
CID 114521082
(5-chlorofuran-2-yl)-(3-cyclopropyloxyphenyl)methanone
CID 106691334
4-amino-1-(3-cyclopropyloxyphenyl)-3-methylbutan-1-one
CID 114523847
(3-cyclopropyloxyphenyl)-(4,5-dimethylthiophen-2-yl)methanone
CID 115813197

Frequently Asked Questions

What is the IUPAC name of (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone?
The IUPAC name of (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone (CID 114521063) is (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone.
What is the SMILES notation for (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone?
The canonical SMILES for (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone is CC(C)c1ccc(C(=O)c2cccc(OC3CC3)c2)cc1.
What is the InChIKey of (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone?
The InChIKey is DDBKKUNBSBDOHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O2/c1-13(2)14-6-8-15(9-7-14)19(20)16-4-3-5-18(12-16)21-17-10-11-17/h3-9,12-13,17H,10-11H2,1-2H3.
What are the key properties of (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone?
(3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone has a molecular weight of 280.37 g/mol, XLogP of 4.58, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-cyclopropyloxyphenyl)-(4-propan-2-ylphenyl)methanone is sourced from PubChem (CID 114521063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).