(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide

C17H21NO4 — CID 8949228

IUPAC(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
SMILESCOCCNC(=O)[C@H](C)Oc1ccc2ccc(OC)cc2c1
InChIInChI=1S/C17H21NO4/c1-12(17(19)18-8-9-20-2)22-16-7-5-13-4-6-15(21-3)10-14(13)11-16/h4-7,10-12H,8-9H2,1-3H3,(H,18,19)/t12-/m0/s1
InChIKeyOMEQKOWCZOOOLO-LBPRGKRZSA-N
MW303.36 g/mol
LogP2.38
Rot. Bonds7

About (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide

(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide (PubChem CID 8949228) has the molecular formula C17H21NO4 and a molecular weight of 303.36 g/mol. Its IUPAC name is (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide.

Molecular Properties

Compound Name(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
PubChem CID8949228
Molecular FormulaC17H21NO4
Molecular Weight303.36 g/mol
Exact Mass303.15
IUPAC Name(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide
SMILESCOCCNC(=O)[C@H](C)Oc1ccc2ccc(OC)cc2c1
InChIInChI=1S/C17H21NO4/c1-12(17(19)18-8-9-20-2)22-16-7-5-13-4-6-15(21-3)10-14(13)11-16/h4-7,10-12H,8-9H2,1-3H3,(H,18,19)/t12-/m0/s1
InChIKeyOMEQKOWCZOOOLO-LBPRGKRZSA-N
XLogP2.38
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(2-methylpropyl)propanamide
CID 8949326
2-(2-bromo-4-methoxyphenoxy)-N-(2-methoxyethyl)propanamide
CID 104707490
(2S)-N-(2-methoxyethyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9207324
2-[2-(1-hydroxyethyl)-5-methoxyphenoxy]-N-(2-methoxyethyl)propanamide
CID 82003316
(2S)-2-(7-methoxynaphthalen-2-yl)oxy-N-[(4-methylphenyl)methyl]propanamide
CID 8949471
2-(3-amino-4-methoxyphenoxy)-N-(2-methoxyethyl)propanamide
CID 103201194
(2S)-N-(2-methoxyethyl)-2-phenoxypropanamide
CID 2162450
(2S)-2-(3-methoxyphenoxy)-N-(3-methoxypropyl)propanamide
CID 92673516
N-[(3-methoxyphenyl)methyl]-2-naphthalen-2-yloxypropanamide
CID 53282955
2-[4-(2-hydroxypropyl)phenoxy]-N-(2-methoxyethyl)propanamide
CID 115495985
2-(3-fluorophenoxy)-N-(2-methoxyethyl)propanamide
CID 60675242
2-(4-methoxyphenoxy)-N-(3-methylbutyl)propanamide
CID 21173373

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide?
The IUPAC name of (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide (CID 8949228) is (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide.
What is the SMILES notation for (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide?
The canonical SMILES for (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide is COCCNC(=O)[C@H](C)Oc1ccc2ccc(OC)cc2c1.
What is the InChIKey of (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide?
The InChIKey is OMEQKOWCZOOOLO-LBPRGKRZSA-N. The full InChI is InChI=1S/C17H21NO4/c1-12(17(19)18-8-9-20-2)22-16-7-5-13-4-6-15(21-3)10-14(13)11-16/h4-7,10-12H,8-9H2,1-3H3,(H,18,19)/t12-/m0/s1.
What are the key properties of (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide?
(2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide has a molecular weight of 303.36 g/mol, XLogP of 2.38, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-methoxyethyl)-2-(7-methoxynaphthalen-2-yl)oxypropanamide is sourced from PubChem (CID 8949228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).