2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone

C17H16O2 — CID 43338938

IUPAC2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C17H16O2/c1-19-16-8-3-2-7-15(16)17(18)14-10-9-12-5-4-6-13(12)11-14/h2-3,7-11H,4-6H2,1H3
InChIKeyNRUBFQFMANLCEO-UHFFFAOYSA-N
MW252.31 g/mol
LogP3.41
Rot. Bonds3

About 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone

2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone (PubChem CID 43338938) has the molecular formula C17H16O2 and a molecular weight of 252.31 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone
PubChem CID43338938
Molecular FormulaC17H16O2
Molecular Weight252.31 g/mol
Exact Mass252.12
IUPAC Name2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)c1ccc2c(c1)CCC2
InChIInChI=1S/C17H16O2/c1-19-16-8-3-2-7-15(16)17(18)14-10-9-12-5-4-6-13(12)11-14/h2-3,7-11H,4-6H2,1H3
InChIKeyNRUBFQFMANLCEO-UHFFFAOYSA-N
XLogP3.41
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.31
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dihydro-1H-inden-5-yl-(5-iodo-2-methoxyphenyl)methanone
CID 43339712
[2-(2,3-dihydro-1H-inden-5-yl)-2-oxoethyl] 2-methoxybenzoate
CID 7485451
2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone
CID 43338936
(3,4-dimethylphenyl)-(2-methoxyphenyl)methanone
CID 24722768
(6-methoxy-2,3-dihydro-1H-inden-5-yl)-phenylmethanone
CID 163828161
2,3-dihydro-1H-inden-5-yl-(4-fluoro-2-methylphenyl)methanone
CID 113399939
[2-[(2-methoxybenzoyl)amino]-2-oxoethyl] 4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoate
CID 46806247
2-methoxy-4-(2-methoxybenzoyl)benzaldehyde
CID 10825897
methyl 4-(2-methoxybenzoyl)benzoate
CID 22408243
2,3-dihydro-1H-inden-5-yl(naphthalen-2-yl)methanone
CID 43338934
2,3-dihydro-1H-inden-5-yl-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 9118183
(2-fluoro-3-methoxyphenyl)-(1,2,3,4-tetrahydroquinolin-6-yl)methanone
CID 116554428

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone (CID 43338938) is 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone is COc1ccccc1C(=O)c1ccc2c(c1)CCC2.
What is the InChIKey of 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone?
The InChIKey is NRUBFQFMANLCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16O2/c1-19-16-8-3-2-7-15(16)17(18)14-10-9-12-5-4-6-13(12)11-14/h2-3,7-11H,4-6H2,1H3.
What are the key properties of 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone?
2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone has a molecular weight of 252.31 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-5-yl-(2-methoxyphenyl)methanone is sourced from PubChem (CID 43338938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).