2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane

C21H22O — CID 142137917

IUPAC2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane
SMILESCOC.c1ccc2c(c1)CC[C@@H]2c1ccc2ccccc2c1
InChIInChI=1S/C19H16.C2H6O/c1-2-7-16-13-17(10-9-14(16)5-1)19-12-11-15-6-3-4-8-18(15)19;1-3-2/h1-10,13,19H,11-12H2;1-2H3/t19-;/m1./s1
InChIKeyVMSQBKHWSVFMMF-FSRHSHDFSA-N
MW290.41 g/mol
LogP5.18
Rot. Bonds1

About 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane

2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane (PubChem CID 142137917) has the molecular formula C21H22O and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane.

Molecular Properties

Compound Name2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane
PubChem CID142137917
Molecular FormulaC21H22O
Molecular Weight290.41 g/mol
Exact Mass290.17
IUPAC Name2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane
SMILESCOC.c1ccc2c(c1)CC[C@@H]2c1ccc2ccccc2c1
InChIInChI=1S/C19H16.C2H6O/c1-2-7-16-13-17(10-9-14(16)5-1)19-12-11-15-6-3-4-8-18(15)19;1-3-2/h1-10,13,19H,11-12H2;1-2H3/t19-;/m1./s1
InChIKeyVMSQBKHWSVFMMF-FSRHSHDFSA-N
XLogP5.18
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.41
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane?
The IUPAC name of 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane (CID 142137917) is 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane.
What is the SMILES notation for 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane?
The canonical SMILES for 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane is COC.c1ccc2c(c1)CC[C@@H]2c1ccc2ccccc2c1.
What is the InChIKey of 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane?
The InChIKey is VMSQBKHWSVFMMF-FSRHSHDFSA-N. The full InChI is InChI=1S/C19H16.C2H6O/c1-2-7-16-13-17(10-9-14(16)5-1)19-12-11-15-6-3-4-8-18(15)19;1-3-2/h1-10,13,19H,11-12H2;1-2H3/t19-;/m1./s1.
What are the key properties of 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane?
2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane has a molecular weight of 290.41 g/mol, XLogP of 5.18, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-2,3-dihydro-1H-inden-1-yl]naphthalene;methoxymethane is sourced from PubChem (CID 142137917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).