(1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol

C18H20O3 — CID 79036087

IUPAC(1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol
SMILESCc1ccc2c(c1)CC(COc1ccccc1[C@@H](C)O)O2
InChIInChI=1S/C18H20O3/c1-12-7-8-17-14(9-12)10-15(21-17)11-20-18-6-4-3-5-16(18)13(2)19/h3-9,13,15,19H,10-11H2,1-2H3/t13-,15?/m1/s1
InChIKeyGRPZCWBALAWPOS-AFYYWNPRSA-N
MW284.36 g/mol
LogP3.43
Rot. Bonds4

About (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol

(1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol (PubChem CID 79036087) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol.

Molecular Properties

Compound Name(1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol
PubChem CID79036087
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name(1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol
SMILESCc1ccc2c(c1)CC(COc1ccccc1[C@@H](C)O)O2
InChIInChI=1S/C18H20O3/c1-12-7-8-17-14(9-12)10-15(21-17)11-20-18-6-4-3-5-16(18)13(2)19/h3-9,13,15,19H,10-11H2,1-2H3/t13-,15?/m1/s1
InChIKeyGRPZCWBALAWPOS-AFYYWNPRSA-N
XLogP3.43
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-iodophenoxy)methyl]-5-methyl-2,3-dihydro-1-benzofuran
CID 66360595
2-[[2-(bromomethyl)-4-methylphenoxy]methyl]-5-methyl-2,3-dihydro-1-benzofuran
CID 66360807
2-[[2-(bromomethyl)-3-chlorophenoxy]methyl]-5-methyl-2,3-dihydro-1-benzofuran
CID 114320962
(2R)-2-(methoxymethyl)-5-methyl-2,3-dihydro-1-benzofuran
CID 58740913
4-chloro-3-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]aniline
CID 66362667
2-[(3-iodophenoxy)methyl]-5-methyl-2,3-dihydro-1-benzofuran
CID 66360407
2-(difluoromethoxymethyl)-5-methyl-2,3-dihydro-1-benzofuran
CID 145338313
[3-chloro-4-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]methanamine
CID 66362855
5-fluoro-2-[(2-fluorophenoxy)methyl]-2,3-dihydro-1-benzofuran
CID 66361307
(1R)-1-[2-(cyclopropylmethoxy)phenyl]ethanol
CID 63364798
(1R)-1-[2-[(2,5-dimethylphenyl)methoxy]phenyl]ethanol
CID 63364801
[2-[(5-fluoro-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]methanol
CID 66364718

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol?
The IUPAC name of (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol (CID 79036087) is (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol.
What is the SMILES notation for (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol?
The canonical SMILES for (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol is Cc1ccc2c(c1)CC(COc1ccccc1[C@@H](C)O)O2.
What is the InChIKey of (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol?
The InChIKey is GRPZCWBALAWPOS-AFYYWNPRSA-N. The full InChI is InChI=1S/C18H20O3/c1-12-7-8-17-14(9-12)10-15(21-17)11-20-18-6-4-3-5-16(18)13(2)19/h3-9,13,15,19H,10-11H2,1-2H3/t13-,15?/m1/s1.
What are the key properties of (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol?
(1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol has a molecular weight of 284.36 g/mol, XLogP of 3.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-[(5-methyl-2,3-dihydro-1-benzofuran-2-yl)methoxy]phenyl]ethanol is sourced from PubChem (CID 79036087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).