(4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol

C15H20O2 — CID 66556328

IUPAC(4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol
SMILESCC(C)=CC1C[C@@H](C)c2ccc(C)c(O)c2O1
InChIInChI=1S/C15H20O2/c1-9(2)7-12-8-11(4)13-6-5-10(3)14(16)15(13)17-12/h5-7,11-12,16H,8H2,1-4H3/t11-,12?/m1/s1
InChIKeyKVZVXEKJZQOJBL-JHJMLUEUSA-N
MW232.32 g/mol
LogP3.92
Rot. Bonds1

About (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol

(4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol (PubChem CID 66556328) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol.

Molecular Properties

Compound Name(4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol
PubChem CID66556328
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name(4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol
SMILESCC(C)=CC1C[C@@H](C)c2ccc(C)c(O)c2O1
InChIInChI=1S/C15H20O2/c1-9(2)7-12-8-11(4)13-6-5-10(3)14(16)15(13)17-12/h5-7,11-12,16H,8H2,1-4H3/t11-,12?/m1/s1
InChIKeyKVZVXEKJZQOJBL-JHJMLUEUSA-N
XLogP3.92
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

8-methoxy-4,7-dimethyl-3,4-dihydro-2H-chromen-2-ol
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(1R,3S)-6-methoxy-1,5-dimethyl-3-(2-methylprop-1-enyl)-2,3-dihydro-1H-indene
CID 25269693
(1R,3R)-6-methoxy-1,5-dimethyl-3-(2-methylprop-1-enyl)-2,3-dihydro-1H-indene
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7-chloro-3,6-dimethyl-2,3-dihydro-1-benzofuran;ethane
CID 143804356
2,6-dimethyl-3-morpholin-2-ylphenol
CID 117296490
3-cyclohexyl-6-methylbenzene-1,2-diol
CID 150190518
7-hydroxy-4,8-dimethyl-3,4-dihydrochromen-2-one
CID 15517821
(2S,4S,4aS,8aS)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4,4a,5,6,8a-hexahydro-2H-chromene
CID 15484403
2-[5-hydroxy-4-(3-methylbut-2-enyl)-8-(2-methylprop-1-enyl)-7-oxabicyclo[4.2.0]octa-1(6),2,4-trien-3-yl]-3,4-dihydro-2H-chromen-7-ol
CID 70673795
(1S)-4,5,8-trimethyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 115417791
(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-ol
CID 640582

Frequently Asked Questions

What is the IUPAC name of (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol?
The IUPAC name of (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol (CID 66556328) is (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol.
What is the SMILES notation for (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol?
The canonical SMILES for (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol is CC(C)=CC1C[C@@H](C)c2ccc(C)c(O)c2O1.
What is the InChIKey of (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol?
The InChIKey is KVZVXEKJZQOJBL-JHJMLUEUSA-N. The full InChI is InChI=1S/C15H20O2/c1-9(2)7-12-8-11(4)13-6-5-10(3)14(16)15(13)17-12/h5-7,11-12,16H,8H2,1-4H3/t11-,12?/m1/s1.
What are the key properties of (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol?
(4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol has a molecular weight of 232.32 g/mol, XLogP of 3.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4,7-dimethyl-2-(2-methylprop-1-enyl)-3,4-dihydro-2H-chromen-8-ol is sourced from PubChem (CID 66556328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).