(2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one

C20H16O — CID 90280813

IUPAC(2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one
SMILESO=C1c2ccccc2CC[C@H]1c1ccc2ccccc2c1
InChIInChI=1S/C20H16O/c21-20-18-8-4-3-6-15(18)11-12-19(20)17-10-9-14-5-1-2-7-16(14)13-17/h1-10,13,19H,11-12H2/t19-/m0/s1
InChIKeyRRPRSSJTPAMJOK-IBGZPJMESA-N
MW272.35 g/mol
LogP4.75
Rot. Bonds1

About (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one

(2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one (PubChem CID 90280813) has the molecular formula C20H16O and a molecular weight of 272.35 g/mol. Its IUPAC name is (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one.

Molecular Properties

Compound Name(2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one
PubChem CID90280813
Molecular FormulaC20H16O
Molecular Weight272.35 g/mol
Exact Mass272.12
IUPAC Name(2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one
SMILESO=C1c2ccccc2CC[C@H]1c1ccc2ccccc2c1
InChIInChI=1S/C20H16O/c21-20-18-8-4-3-6-15(18)11-12-19(20)17-10-9-14-5-1-2-7-16(14)13-17/h1-10,13,19H,11-12H2/t19-/m0/s1
InChIKeyRRPRSSJTPAMJOK-IBGZPJMESA-N
XLogP4.75
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one?
The IUPAC name of (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one (CID 90280813) is (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one.
What is the SMILES notation for (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one?
The canonical SMILES for (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one is O=C1c2ccccc2CC[C@H]1c1ccc2ccccc2c1.
What is the InChIKey of (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one?
The InChIKey is RRPRSSJTPAMJOK-IBGZPJMESA-N. The full InChI is InChI=1S/C20H16O/c21-20-18-8-4-3-6-15(18)11-12-19(20)17-10-9-14-5-1-2-7-16(14)13-17/h1-10,13,19H,11-12H2/t19-/m0/s1.
What are the key properties of (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one?
(2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one has a molecular weight of 272.35 g/mol, XLogP of 4.75, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-naphthalen-2-yl-3,4-dihydro-2H-naphthalen-1-one is sourced from PubChem (CID 90280813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).