(2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide

C20H21NO2S — CID 27770310

IUPAC(2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NCCc3cccs3)ccc2c1
InChIInChI=1S/C20H21NO2S/c1-14(20(22)21-10-9-19-4-3-11-24-19)15-5-6-17-13-18(23-2)8-7-16(17)12-15/h3-8,11-14H,9-10H2,1-2H3,(H,21,22)/t14-/m0/s1
InChIKeyRCEFOSMISLXMES-AWEZNQCLSA-N
MW339.46 g/mol
LogP4.37
Rot. Bonds6

About (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide

(2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide (PubChem CID 27770310) has the molecular formula C20H21NO2S and a molecular weight of 339.46 g/mol. Its IUPAC name is (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide
PubChem CID27770310
Molecular FormulaC20H21NO2S
Molecular Weight339.46 g/mol
Exact Mass339.13
IUPAC Name(2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NCCc3cccs3)ccc2c1
InChIInChI=1S/C20H21NO2S/c1-14(20(22)21-10-9-19-4-3-11-24-19)15-5-6-17-13-18(23-2)8-7-16(17)12-15/h3-8,11-14H,9-10H2,1-2H3,(H,21,22)/t14-/m0/s1
InChIKeyRCEFOSMISLXMES-AWEZNQCLSA-N
XLogP4.37
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.46
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 18161802
(6-methoxynaphthalen-2-yl)methyl-methyl-[(2R)-1-oxo-1-(2-thiophen-2-ylethylamino)propan-2-yl]azanium
CID 8925268
N-[2-(ethylamino)ethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 119505947
(2S)-N-(2-methoxyethyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9207324
N-ethyl-2-(6-methoxynaphthalen-2-yl)-N-(thiophen-2-ylmethyl)propanamide
CID 45351967
(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 110901591
2-[2-(6-methoxynaphthalen-2-yl)propyl]thiophene
CID 67595197
(2S)-2-(6-methoxynaphthalen-2-yl)-N-[(2R)-2-phenylpropyl]propanamide
CID 9427304
2-(4-methoxyphenyl)sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)acetamide
CID 27562284
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
CID 92850098
N-[2-(4-ethoxyphenoxy)ethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 42917740
(2S)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9372222

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide?
The IUPAC name of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide (CID 27770310) is (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide.
What is the SMILES notation for (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide?
The canonical SMILES for (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide is COc1ccc2cc([C@H](C)C(=O)NCCc3cccs3)ccc2c1.
What is the InChIKey of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide?
The InChIKey is RCEFOSMISLXMES-AWEZNQCLSA-N. The full InChI is InChI=1S/C20H21NO2S/c1-14(20(22)21-10-9-19-4-3-11-24-19)15-5-6-17-13-18(23-2)8-7-16(17)12-15/h3-8,11-14H,9-10H2,1-2H3,(H,21,22)/t14-/m0/s1.
What are the key properties of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide?
(2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide has a molecular weight of 339.46 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(6-methoxynaphthalen-2-yl)-N-(2-thiophen-2-ylethyl)propanamide is sourced from PubChem (CID 27770310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).