(2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one

C16H14O2 — CID 44570285

IUPAC(2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one
SMILESCc1ccc2ccccc2c1[C@H]1CC=CC(=O)O1
InChIInChI=1S/C16H14O2/c1-11-9-10-12-5-2-3-6-13(12)16(11)14-7-4-8-15(17)18-14/h2-6,8-10,14H,7H2,1H3/t14-/m1/s1
InChIKeyNRBYLRIBVNIKBN-CQSZACIVSA-N
MW238.29 g/mol
LogP3.69
Rot. Bonds1

About (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one

(2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one (PubChem CID 44570285) has the molecular formula C16H14O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one.

Molecular Properties

Compound Name(2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one
PubChem CID44570285
Molecular FormulaC16H14O2
Molecular Weight238.29 g/mol
Exact Mass238.10
IUPAC Name(2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one
SMILESCc1ccc2ccccc2c1[C@H]1CC=CC(=O)O1
InChIInChI=1S/C16H14O2/c1-11-9-10-12-5-2-3-6-13(12)16(11)14-7-4-8-15(17)18-14/h2-6,8-10,14H,7H2,1H3/t14-/m1/s1
InChIKeyNRBYLRIBVNIKBN-CQSZACIVSA-N
XLogP3.69
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one?
The IUPAC name of (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one (CID 44570285) is (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one.
What is the SMILES notation for (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one?
The canonical SMILES for (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one is Cc1ccc2ccccc2c1[C@H]1CC=CC(=O)O1.
What is the InChIKey of (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one?
The InChIKey is NRBYLRIBVNIKBN-CQSZACIVSA-N. The full InChI is InChI=1S/C16H14O2/c1-11-9-10-12-5-2-3-6-13(12)16(11)14-7-4-8-15(17)18-14/h2-6,8-10,14H,7H2,1H3/t14-/m1/s1.
What are the key properties of (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one?
(2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one has a molecular weight of 238.29 g/mol, XLogP of 3.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-methylnaphthalen-1-yl)-2,3-dihydropyran-6-one is sourced from PubChem (CID 44570285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).