6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol

C19H22O2 — CID 114715181

IUPAC6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol
SMILESCc1ccc2c(c1)C(O)CC(c1ccc(C(C)C)cc1)O2
InChIInChI=1S/C19H22O2/c1-12(2)14-5-7-15(8-6-14)19-11-17(20)16-10-13(3)4-9-18(16)21-19/h4-10,12,17,19-20H,11H2,1-3H3
InChIKeyROHDHDLJCVXKNQ-UHFFFAOYSA-N
MW282.38 g/mol
LogP4.68
Rot. Bonds2

About 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol

6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol (PubChem CID 114715181) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol.

Molecular Properties

Compound Name6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol
PubChem CID114715181
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol
SMILESCc1ccc2c(c1)C(O)CC(c1ccc(C(C)C)cc1)O2
InChIInChI=1S/C19H22O2/c1-12(2)14-5-7-15(8-6-14)19-11-17(20)16-10-13(3)4-9-18(16)21-19/h4-10,12,17,19-20H,11H2,1-3H3
InChIKeyROHDHDLJCVXKNQ-UHFFFAOYSA-N
XLogP4.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-2-[4-(difluoromethyl)phenyl]-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 104950334
2-(4-chlorophenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 114715194
2-(4-hydroxyphenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 114715244
(4S)-2-(4-ethylphenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 104950688
2-(4-ethylphenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 114715251
(4S)-2-(3-chloro-4-hydroxyphenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 104950608
(4R)-2-(4-chloro-3-fluorophenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 104950383
(4S)-2-(4-chloro-3-fluorophenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 104950609
2-(3-hydroxyphenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 114715253
2-(2,3-dichlorophenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 114715161
(4R)-2-(2,3-dichlorophenyl)-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 104950366
6-chloro-2-(3,5-dimethylphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114714427

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol?
The IUPAC name of 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol (CID 114715181) is 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol.
What is the SMILES notation for 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol?
The canonical SMILES for 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol is Cc1ccc2c(c1)C(O)CC(c1ccc(C(C)C)cc1)O2.
What is the InChIKey of 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol?
The InChIKey is ROHDHDLJCVXKNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-12(2)14-5-7-15(8-6-14)19-11-17(20)16-10-13(3)4-9-18(16)21-19/h4-10,12,17,19-20H,11H2,1-3H3.
What are the key properties of 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol?
6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol has a molecular weight of 282.38 g/mol, XLogP of 4.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol is sourced from PubChem (CID 114715181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).