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

C19H22O2 — CID 114715231

IUPAC6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol
SMILESCc1ccc2c(c1)C(O)CC(CC(C)c1ccccc1)O2
InChIInChI=1S/C19H22O2/c1-13-8-9-19-17(10-13)18(20)12-16(21-19)11-14(2)15-6-4-3-5-7-15/h3-10,14,16,18,20H,11-12H2,1-2H3
InChIKeyQPKQGDSBPWHWKR-UHFFFAOYSA-N
MW282.38 g/mol
LogP4.37
Rot. Bonds3

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

6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol (PubChem CID 114715231) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol.

Molecular Properties

Compound Name6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol
PubChem CID114715231
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol
SMILESCc1ccc2c(c1)C(O)CC(CC(C)c1ccccc1)O2
InChIInChI=1S/C19H22O2/c1-13-8-9-19-17(10-13)18(20)12-16(21-19)11-14(2)15-6-4-3-5-7-15/h3-10,14,16,18,20H,11-12H2,1-2H3
InChIKeyQPKQGDSBPWHWKR-UHFFFAOYSA-N
XLogP4.37
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4S)-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol
CID 104949968
7-bromo-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol
CID 114714792
(4S)-7-fluoro-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol
CID 104951956
(4R)-6-fluoro-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-amine
CID 104944437
6-bromo-2-(2-methylpropyl)-3,4-dihydro-2H-chromen-4-ol
CID 114715630
(2R,4R)-2,6-dimethyl-3,4-dihydro-2H-chromen-4-ol
CID 124573509
6-methyl-2-(4-propan-2-ylphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 114715181
7-fluoro-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-amine
CID 114710317
3-(2-phenylpropyl)-6-propan-2-yl-2,3-dihydro-1,4-benzodioxine
CID 170149059
(4R)-6-chloro-2-(1-phenylethyl)-3,4-dihydro-2H-chromen-4-ol
CID 104949200
(4R)-2-[4-(difluoromethyl)phenyl]-6-methyl-3,4-dihydro-2H-chromen-4-ol
CID 104950334
6-methyl-2-(oxolan-3-yl)-3,4-dihydro-2H-chromen-4-ol
CID 114715178

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol?
The IUPAC name of 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol (CID 114715231) is 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol.
What is the SMILES notation for 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol?
The canonical SMILES for 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol is Cc1ccc2c(c1)C(O)CC(CC(C)c1ccccc1)O2.
What is the InChIKey of 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol?
The InChIKey is QPKQGDSBPWHWKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c1-13-8-9-19-17(10-13)18(20)12-16(21-19)11-14(2)15-6-4-3-5-7-15/h3-10,14,16,18,20H,11-12H2,1-2H3.
What are the key properties of 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol?
6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol has a molecular weight of 282.38 g/mol, XLogP of 4.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(2-phenylpropyl)-3,4-dihydro-2H-chromen-4-ol is sourced from PubChem (CID 114715231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).