2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol

C20H19NO2 — CID 175134367

IUPAC2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol
SMILESCC(C)c1c(O)cc(C=Cc2ccc3ccccc3n2)cc1O
InChIInChI=1S/C20H19NO2/c1-13(2)20-18(22)11-14(12-19(20)23)7-9-16-10-8-15-5-3-4-6-17(15)21-16/h3-13,22-23H,1-2H3
InChIKeyIXSZSWJBKBFXJN-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.94
Rot. Bonds3

About 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol

2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol (PubChem CID 175134367) has the molecular formula C20H19NO2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol.

Molecular Properties

Compound Name2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol
PubChem CID175134367
Molecular FormulaC20H19NO2
Molecular Weight305.38 g/mol
Exact Mass305.14
IUPAC Name2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol
SMILESCC(C)c1c(O)cc(C=Cc2ccc3ccccc3n2)cc1O
InChIInChI=1S/C20H19NO2/c1-13(2)20-18(22)11-14(12-19(20)23)7-9-16-10-8-15-5-3-4-6-17(15)21-16/h3-13,22-23H,1-2H3
InChIKeyIXSZSWJBKBFXJN-UHFFFAOYSA-N
XLogP4.94
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-propan-2-yl-5-(2-pyridin-2-ylethenyl)benzene-1,3-diol;hydrochloride
CID 68799721
2-methoxy-5-[(E)-2-quinolin-2-ylethenyl]phenol
CID 5474190
ethane;5-[(E)-2-phenylethenyl]-2-propan-2-ylbenzene-1,3-diol
CID 176681357
2-[(E)-2-phenylethenyl]quinoline;sulfuric acid
CID 75366284
2-propan-2-yl-5-[(E)-2-(1,3-thiazol-4-yl)ethenyl]benzene-1,3-diol
CID 165177484
5-[(1E,3E)-4-phenylbuta-1,3-dienyl]-2-propan-2-ylbenzene-1,3-diol
CID 71488581
5-(methylamino)-2-[(E)-2-quinolin-2-ylethenyl]phenol
CID 135518122
2-[(E)-2-(4-chlorophenyl)ethenyl]quinoline
CID 5377682
trimethyl-[4-(2-quinolin-2-ylethenyl)phenyl]azanium
CID 2750433
2-[(E)-2-(3-bromophenyl)ethenyl]quinoline
CID 5378705
2-[(E)-2-(1H-indol-5-yl)ethenyl]quinoline
CID 142044528
2-[N-methyl-4-[(E)-2-quinolin-2-ylethenyl]anilino]propanoic acid
CID 20709092

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol?
The IUPAC name of 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol (CID 175134367) is 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol.
What is the SMILES notation for 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol?
The canonical SMILES for 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol is CC(C)c1c(O)cc(C=Cc2ccc3ccccc3n2)cc1O.
What is the InChIKey of 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol?
The InChIKey is IXSZSWJBKBFXJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO2/c1-13(2)20-18(22)11-14(12-19(20)23)7-9-16-10-8-15-5-3-4-6-17(15)21-16/h3-13,22-23H,1-2H3.
What are the key properties of 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol?
2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol has a molecular weight of 305.38 g/mol, XLogP of 4.94, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-5-(2-quinolin-2-ylethenyl)benzene-1,3-diol is sourced from PubChem (CID 175134367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).