2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene

C15H22O3 — CID 10729365

IUPAC2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene
SMILESCOC1CC(C)(OC)Oc2ccc(C(C)C)cc21
InChIInChI=1S/C15H22O3/c1-10(2)11-6-7-13-12(8-11)14(16-4)9-15(3,17-5)18-13/h6-8,10,14H,9H2,1-5H3
InChIKeyHXYWJZCIKSCCRY-UHFFFAOYSA-N
MW250.34 g/mol
LogP3.64
Rot. Bonds3

About 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene

2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene (PubChem CID 10729365) has the molecular formula C15H22O3 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene.

Molecular Properties

Compound Name2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene
PubChem CID10729365
Molecular FormulaC15H22O3
Molecular Weight250.34 g/mol
Exact Mass250.16
IUPAC Name2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene
SMILESCOC1CC(C)(OC)Oc2ccc(C(C)C)cc21
InChIInChI=1S/C15H22O3/c1-10(2)11-6-7-13-12(8-11)14(16-4)9-15(3,17-5)18-13/h6-8,10,14H,9H2,1-5H3
InChIKeyHXYWJZCIKSCCRY-UHFFFAOYSA-N
XLogP3.64
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4S)-2,4-dimethoxy-2-methyl-3,4-dihydrochromene
CID 101362429
2-(2,2-dimethyl-6-propan-2-yl-3,4-dihydrochromen-4-yl)ethanamine
CID 82086635
ethane;2-fluoro-2-methyl-5-propan-2-yl-1,3-benzodioxole
CID 145165904
6-propan-2-ylspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-carboxylic acid
CID 82093660
6-propan-2-yl-2,3-dihydro-1,4-benzodioxine
CID 22951095
6-propan-2-yl-1,4-benzodioxine
CID 20686951
2,2-dimethyl-3-(2-methyl-5-propan-2-ylphenyl)oxirane
CID 116864074
azane;methane;6-propan-2-yl-2,3-dihydro-1,4-benzodioxine
CID 159540292
2,2,3,3-tetradeuterio-6-propan-2-yl-1,4-benzodioxine
CID 88993276
2-ethyl-6-fluoro-2-methyl-4-propan-2-yloxy-3,4-dihydrochromene
CID 123599111
4b,9b-dihydroxy-2,3-dimethoxy-7-propan-2-ylindeno[1,2-b][1]benzofuran-10-one
CID 90097629
2-methyl-6-propan-2-yl-2,3-dihydro-1,4-benzodioxine
CID 134391362

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene?
The IUPAC name of 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene (CID 10729365) is 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene.
What is the SMILES notation for 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene?
The canonical SMILES for 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene is COC1CC(C)(OC)Oc2ccc(C(C)C)cc21.
What is the InChIKey of 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene?
The InChIKey is HXYWJZCIKSCCRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O3/c1-10(2)11-6-7-13-12(8-11)14(16-4)9-15(3,17-5)18-13/h6-8,10,14H,9H2,1-5H3.
What are the key properties of 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene?
2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene has a molecular weight of 250.34 g/mol, XLogP of 3.64, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-2-methyl-6-propan-2-yl-3,4-dihydrochromene is sourced from PubChem (CID 10729365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).