1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone

C20H21N3O2 — CID 124995684

IUPAC1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone
SMILESCc1cnc([C@@H]2CN(C(=O)Cc3ccc4ccccc4c3)CCO2)[nH]1
InChIInChI=1S/C20H21N3O2/c1-14-12-21-20(22-14)18-13-23(8-9-25-18)19(24)11-15-6-7-16-4-2-3-5-17(16)10-15/h2-7,10,12,18H,8-9,11,13H2,1H3,(H,21,22)/t18-/m0/s1
InChIKeyQNWIOHYCMAHRJC-SFHVURJKSA-N
MW335.41 g/mol
LogP3.01
Rot. Bonds3

About 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone

1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone (PubChem CID 124995684) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone.

Molecular Properties

Compound Name1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone
PubChem CID124995684
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone
SMILESCc1cnc([C@@H]2CN(C(=O)Cc3ccc4ccccc4c3)CCO2)[nH]1
InChIInChI=1S/C20H21N3O2/c1-14-12-21-20(22-14)18-13-23(8-9-25-18)19(24)11-15-6-7-16-4-2-3-5-17(16)10-15/h2-7,10,12,18H,8-9,11,13H2,1H3,(H,21,22)/t18-/m0/s1
InChIKeyQNWIOHYCMAHRJC-SFHVURJKSA-N
XLogP3.01
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-methoxyphenyl)-1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 124978039
2-(2,3-dihydro-1H-inden-5-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 110105208
1-[3-(5-methyl-1H-imidazol-2-yl)piperidin-1-yl]-2-naphthalen-2-ylethanone
CID 110104199
1-[(2R)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-3-phenylpropan-1-one
CID 124972553
1-[2-(3-aminopyrazin-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone
CID 110112851
2-cyclopropyl-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 73439823
1-[2-(hydroxymethyl)morpholin-4-yl]-2-naphthalen-2-ylethanone
CID 81196890
2-(2-chloro-6-fluorophenyl)-1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]ethanone
CID 125012194
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-morpholin-4-ylethanone
CID 124953608
3-(1H-indol-3-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one
CID 155899693
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-3-thiophen-2-ylpropan-1-one
CID 124960617
3-(2,3-dihydroindol-1-yl)-1-[2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]propan-1-one
CID 110105309

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone?
The IUPAC name of 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone (CID 124995684) is 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone.
What is the SMILES notation for 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone?
The canonical SMILES for 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone is Cc1cnc([C@@H]2CN(C(=O)Cc3ccc4ccccc4c3)CCO2)[nH]1.
What is the InChIKey of 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone?
The InChIKey is QNWIOHYCMAHRJC-SFHVURJKSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-14-12-21-20(22-14)18-13-23(8-9-25-18)19(24)11-15-6-7-16-4-2-3-5-17(16)10-15/h2-7,10,12,18H,8-9,11,13H2,1H3,(H,21,22)/t18-/m0/s1.
What are the key properties of 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone?
1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone has a molecular weight of 335.41 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-(5-methyl-1H-imidazol-2-yl)morpholin-4-yl]-2-naphthalen-2-ylethanone is sourced from PubChem (CID 124995684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).