(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide

C21H21NO2 — CID 9038954

IUPAC(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)Nc3cccc(C)c3)ccc2c1
InChIInChI=1S/C21H21NO2/c1-14-5-4-6-19(11-14)22-21(23)15(2)16-7-8-18-13-20(24-3)10-9-17(18)12-16/h4-13,15H,1-3H3,(H,22,23)/t15-/m0/s1
InChIKeyABIQVECWONTVOG-HNNXBMFYSA-N
MW319.40 g/mol
LogP4.90
Rot. Bonds4

About (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide

(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide (PubChem CID 9038954) has the molecular formula C21H21NO2 and a molecular weight of 319.40 g/mol. Its IUPAC name is (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide
PubChem CID9038954
Molecular FormulaC21H21NO2
Molecular Weight319.40 g/mol
Exact Mass319.16
IUPAC Name(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)Nc3cccc(C)c3)ccc2c1
InChIInChI=1S/C21H21NO2/c1-14-5-4-6-19(11-14)22-21(23)15(2)16-7-8-18-13-20(24-3)10-9-17(18)12-16/h4-13,15H,1-3H3,(H,22,23)/t15-/m0/s1
InChIKeyABIQVECWONTVOG-HNNXBMFYSA-N
XLogP4.90
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]amino]phenyl]-2,2-dimethylpropanamide
CID 54790136
(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-phenylmethoxyphenyl)propanamide
CID 54789941
2-(4-methoxyanilino)-N-(3-methylphenyl)propanamide
CID 46757337
N-[4-(difluoromethoxy)phenyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 55363194
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
CID 92850098
(2S)-N-(4-cyanophenyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 26689476
[(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl] (2S)-2-(6-methoxynaphthalen-2-yl)propanoate
CID 8952069
(2R)-2-[(6-methoxynaphthalen-2-yl)methyl-methylamino]-N-(3-methylphenyl)propanamide
CID 25482866
ethyl-di(propan-2-yl)azanium;3-[2-(6-methoxynaphthalen-2-yl)propanoylamino]benzenesulfonate
CID 155294994
[(1S)-1-(4-methoxyphenyl)propyl]-[(2R)-1-(3-methylanilino)-1-oxopropan-2-yl]azanium
CID 8646102
(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylsulfonylphenyl)propanamide
CID 55937981
(2S)-N-[3-[(2-methoxyacetyl)amino]phenyl]-2-(4-methoxyphenyl)propanamide
CID 95616058

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide?
The IUPAC name of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide (CID 9038954) is (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide.
What is the SMILES notation for (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide?
The canonical SMILES for (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide is COc1ccc2cc([C@H](C)C(=O)Nc3cccc(C)c3)ccc2c1.
What is the InChIKey of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide?
The InChIKey is ABIQVECWONTVOG-HNNXBMFYSA-N. The full InChI is InChI=1S/C21H21NO2/c1-14-5-4-6-19(11-14)22-21(23)15(2)16-7-8-18-13-20(24-3)10-9-17(18)12-16/h4-13,15H,1-3H3,(H,22,23)/t15-/m0/s1.
What are the key properties of (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide?
(2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide has a molecular weight of 319.40 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(6-methoxynaphthalen-2-yl)-N-(3-methylphenyl)propanamide is sourced from PubChem (CID 9038954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).