(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid

C14H14O3 — CID 93477602

IUPAC(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid
SMILESCOc1ccc2ccc([C@@H](C)C(=O)O)cc2c1
InChIInChI=1S/C14H14O3/c1-9(14(15)16)11-4-3-10-5-6-13(17-2)8-12(10)7-11/h3-9H,1-2H3,(H,15,16)/t9-/m1/s1
InChIKeyMIJUDPHTZVRTNN-SECBINFHSA-N
MW230.26 g/mol
LogP3.04
Rot. Bonds3

About (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid

(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid (PubChem CID 93477602) has the molecular formula C14H14O3 and a molecular weight of 230.26 g/mol. Its IUPAC name is (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid.

Molecular Properties

Compound Name(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid
PubChem CID93477602
Molecular FormulaC14H14O3
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid
SMILESCOc1ccc2ccc([C@@H](C)C(=O)O)cc2c1
InChIInChI=1S/C14H14O3/c1-9(14(15)16)11-4-3-10-5-6-13(17-2)8-12(10)7-11/h3-9H,1-2H3,(H,15,16)/t9-/m1/s1
InChIKeyMIJUDPHTZVRTNN-SECBINFHSA-N
XLogP3.04
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

potassium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 174215246
sodium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 173070735
magnesium;hydride;2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 174047871
bis((2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid);piperazine
CID 76968825
3-(6-methoxynaphthalen-2-yl)butan-2-one
CID 13292512
3,3,3-trideuterio-2-(6-methoxynaphthalen-2-yl)(313C)propanoic acid
CID 46782447
1-hydroxypyrrolidine-2,5-dione;(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 131744188
(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid;2-methylpyridine
CID 175762136
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
CID 92850098
chloro (2S)-2-(6-methoxynaphthalen-2-yl)propanoate
CID 90693422
phenyl (2S)-2-(6-methoxynaphthalen-2-yl)propanoate
CID 129098564
ethyl 4-aminobenzoate;(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid
CID 121437225

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid?
The IUPAC name of (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid (CID 93477602) is (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid.
What is the SMILES notation for (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid?
The canonical SMILES for (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid is COc1ccc2ccc([C@@H](C)C(=O)O)cc2c1.
What is the InChIKey of (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid?
The InChIKey is MIJUDPHTZVRTNN-SECBINFHSA-N. The full InChI is InChI=1S/C14H14O3/c1-9(14(15)16)11-4-3-10-5-6-13(17-2)8-12(10)7-11/h3-9H,1-2H3,(H,15,16)/t9-/m1/s1.
What are the key properties of (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid?
(2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid has a molecular weight of 230.26 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(7-methoxynaphthalen-2-yl)propanoic acid is sourced from PubChem (CID 93477602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).