1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene

C17H18O — CID 101467069

IUPAC1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene
SMILESCOc1ccc(CC2CCc3ccccc32)cc1
InChIInChI=1S/C17H18O/c1-18-16-10-6-13(7-11-16)12-15-9-8-14-4-2-3-5-17(14)15/h2-7,10-11,15H,8-9,12H2,1H3
InChIKeySKKOGRQZKLNSHC-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.97
Rot. Bonds3

About 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene

1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene (PubChem CID 101467069) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene
PubChem CID101467069
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene
SMILESCOc1ccc(CC2CCc3ccccc32)cc1
InChIInChI=1S/C17H18O/c1-18-16-10-6-13(7-11-16)12-15-9-8-14-4-2-3-5-17(14)15/h2-7,10-11,15H,8-9,12H2,1H3
InChIKeySKKOGRQZKLNSHC-UHFFFAOYSA-N
XLogP3.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(1S)-1-benzyl-2,3-dihydro-1H-indene
CID 134957742
1-(2,3-dihydro-1H-inden-1-yl)-3-(4-methoxyphenyl)propan-1-one
CID 65446449
(1R)-1-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 132584955
3-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indole
CID 22037969
(1S,2R)-1-[(4-methoxyphenyl)methyl]-N-methyl-2,3-dihydro-1H-inden-2-amine
CID 67652206
1-ethyl-2,3-dihydro-1H-indene
CID 20971
1-[(4-methoxyphenyl)methyl]-2-propyl-3,4-dihydro-1H-isoquinoline
CID 71396455
(2R)-2-benzyl-6-methoxy-3,4-dihydro-2H-naphthalen-1-one
CID 101410052
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-2-(4-methoxyphenyl)-N-methylacetamide
CID 52557701
1-(cyclopropylmethyl)-4-methoxybenzene
CID 6422476
(9R,18S,27R)-9,18,27-tris[(4-methoxyphenyl)methyl]heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 100981985
2-[(4-methoxyphenyl)methyl]cyclopentan-1-one
CID 11790327

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene?
The IUPAC name of 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene (CID 101467069) is 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene.
What is the SMILES notation for 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene?
The canonical SMILES for 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene is COc1ccc(CC2CCc3ccccc32)cc1.
What is the InChIKey of 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene?
The InChIKey is SKKOGRQZKLNSHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-18-16-10-6-13(7-11-16)12-15-9-8-14-4-2-3-5-17(14)15/h2-7,10-11,15H,8-9,12H2,1H3.
What are the key properties of 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene?
1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene has a molecular weight of 238.33 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-indene is sourced from PubChem (CID 101467069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).