(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene

C20H24O2 — CID 70422364

IUPAC(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene
SMILESCc1c(C)c2c(c(C)c1OCc1ccccc1)CC[C@H](C)O2
InChIInChI=1S/C20H24O2/c1-13-10-11-18-16(4)19(14(2)15(3)20(18)22-13)21-12-17-8-6-5-7-9-17/h5-9,13H,10-12H2,1-4H3/t13-/m0/s1
InChIKeyTWYIROONGVIKEA-ZDUSSCGKSA-N
MW296.41 g/mol
LogP4.90
Rot. Bonds3

About (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene

(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene (PubChem CID 70422364) has the molecular formula C20H24O2 and a molecular weight of 296.41 g/mol. Its IUPAC name is (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene
PubChem CID70422364
Molecular FormulaC20H24O2
Molecular Weight296.41 g/mol
Exact Mass296.18
IUPAC Name(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene
SMILESCc1c(C)c2c(c(C)c1OCc1ccccc1)CC[C@H](C)O2
InChIInChI=1S/C20H24O2/c1-13-10-11-18-16(4)19(14(2)15(3)20(18)22-13)21-12-17-8-6-5-7-9-17/h5-9,13H,10-12H2,1-4H3/t13-/m0/s1
InChIKeyTWYIROONGVIKEA-ZDUSSCGKSA-N
XLogP4.90
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-(methoxymethoxy)-2,5,7,8-tetramethyl-3,4-dihydro-2H-chromene
CID 172845448
2,5,7,8-tetramethyl-6-phenylmethoxy-4H-chromene
CID 10108511
N,N-dimethyl-2-(4,6,7-trimethyl-5-phenylmethoxy-2,3-dihydro-1-benzofuran-2-yl)ethanamine;hydrochloride
CID 19899205
N,N-dimethyl-2-[(2S)-4,6,7-trimethyl-5-phenylmethoxy-2,3-dihydro-1-benzofuran-2-yl]ethanamine;hydrochloride
CID 67795307
2,5,7,8-tetramethyl-6-(5-methylhex-5-enoxy)-3,4-dihydro-2H-chromene
CID 142338753
2,5,7,8-tetramethyl-6-phenylmethoxy-2-prop-2-enyl-3,4-dihydrochromene
CID 14210609
methyl 2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromene-2-carboxylate
CID 10570125
3-(2,2,5,7-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-8-yl)propanal
CID 19877353
(3,7-dimethylbicyclo[3.3.1]nonane-1-carbonyl) 2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydrochromene-2-carboxylate;ethane
CID 166169591
2,3,5,6-tetramethyl-4-phenylmethoxybenzaldehyde
CID 71408995
3-(2,2,5,7-tetramethyl-6-phenylmethoxy-3,4-dihydrochromen-8-yl)propanoic acid
CID 67942088
9-methyl-10-phenylmethoxy-1,2,3,4-tetrahydrophenanthrene
CID 71501787

Frequently Asked Questions

What is the IUPAC name of (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene?
The IUPAC name of (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene (CID 70422364) is (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene.
What is the SMILES notation for (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene?
The canonical SMILES for (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene is Cc1c(C)c2c(c(C)c1OCc1ccccc1)CC[C@H](C)O2.
What is the InChIKey of (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene?
The InChIKey is TWYIROONGVIKEA-ZDUSSCGKSA-N. The full InChI is InChI=1S/C20H24O2/c1-13-10-11-18-16(4)19(14(2)15(3)20(18)22-13)21-12-17-8-6-5-7-9-17/h5-9,13H,10-12H2,1-4H3/t13-/m0/s1.
What are the key properties of (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene?
(2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene has a molecular weight of 296.41 g/mol, XLogP of 4.90, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,5,7,8-tetramethyl-6-phenylmethoxy-3,4-dihydro-2H-chromene is sourced from PubChem (CID 70422364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).