(4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane

C23H30O4 — CID 143308390

IUPAC(4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane
SMILESCC(C)C.CC(C)Oc1ccc(C(=O)c2ccc(C3CC3)cc2O)c(O)c1
InChIInChI=1S/C19H20O4.C4H10/c1-11(2)23-14-6-8-16(18(21)10-14)19(22)15-7-5-13(9-17(15)20)12-3-4-12;1-4(2)3/h5-12,20-21H,3-4H2,1-2H3;4H,1-3H3
InChIKeyNPUFIPLFOYIWRW-UHFFFAOYSA-N
MW370.49 g/mol
LogP5.66
Rot. Bonds5

About (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane

(4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane (PubChem CID 143308390) has the molecular formula C23H30O4 and a molecular weight of 370.49 g/mol. Its IUPAC name is (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane.

Molecular Properties

Compound Name(4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane
PubChem CID143308390
Molecular FormulaC23H30O4
Molecular Weight370.49 g/mol
Exact Mass370.21
IUPAC Name(4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane
SMILESCC(C)C.CC(C)Oc1ccc(C(=O)c2ccc(C3CC3)cc2O)c(O)c1
InChIInChI=1S/C19H20O4.C4H10/c1-11(2)23-14-6-8-16(18(21)10-14)19(22)15-7-5-13(9-17(15)20)12-3-4-12;1-4(2)3/h5-12,20-21H,3-4H2,1-2H3;4H,1-3H3
InChIKeyNPUFIPLFOYIWRW-UHFFFAOYSA-N
XLogP5.66
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.49
LogP ≤ 55.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Genistein
CID 5280961
2-Hydroxy-4-methoxybenzophenone
CID 4632
Octabenzone
CID 15797
Apigenin
CID 5280443
Diosmetin
CID 5281612
Hesperetin
CID 72281
Naringenin
CID 439246
Kaempferol
CID 5280863
Daidzein
CID 5281708
Chrysin
CID 5281607
Zearalenone
CID 5281576
Paeonol
CID 11092

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane?
The IUPAC name of (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane (CID 143308390) is (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane.
What is the SMILES notation for (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane?
The canonical SMILES for (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane is CC(C)C.CC(C)Oc1ccc(C(=O)c2ccc(C3CC3)cc2O)c(O)c1.
What is the InChIKey of (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane?
The InChIKey is NPUFIPLFOYIWRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O4.C4H10/c1-11(2)23-14-6-8-16(18(21)10-14)19(22)15-7-5-13(9-17(15)20)12-3-4-12;1-4(2)3/h5-12,20-21H,3-4H2,1-2H3;4H,1-3H3.
What are the key properties of (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane?
(4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane has a molecular weight of 370.49 g/mol, XLogP of 5.66, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropyl-2-hydroxyphenyl)-(2-hydroxy-4-propan-2-yloxyphenyl)methanone;2-methylpropane is sourced from PubChem (CID 143308390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).