[benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone

C20H25NO2Sn — CID 174435606

IUPAC[benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone
SMILESC[Sn](C)(Cc1ccccc1)C(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C11H12NO2.C7H7.2CH3.Sn/c13-9-10-1-3-11(4-2-10)12-5-7-14-8-6-12;1-7-5-3-2-4-6-7;;;/h1-4H,5-8H2;2-6H,1H2;2*1H3;
InChIKeyLBWDLDNDXSABED-UHFFFAOYSA-N
MW430.14 g/mol
LogP3.74
Rot. Bonds5

About [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone

[benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone (PubChem CID 174435606) has the molecular formula C20H25NO2Sn and a molecular weight of 430.14 g/mol. Its IUPAC name is [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone.

Molecular Properties

Compound Name[benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone
PubChem CID174435606
Molecular FormulaC20H25NO2Sn
Molecular Weight430.14 g/mol
Exact Mass431.09
IUPAC Name[benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone
SMILESC[Sn](C)(Cc1ccccc1)C(=O)c1ccc(N2CCOCC2)cc1
InChIInChI=1S/C11H12NO2.C7H7.2CH3.Sn/c13-9-10-1-3-11(4-2-10)12-5-7-14-8-6-12;1-7-5-3-2-4-6-7;;;/h1-4H,5-8H2;2-6H,1H2;2*1H3;
InChIKeyLBWDLDNDXSABED-UHFFFAOYSA-N
XLogP3.74
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.14
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone 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-morpholin-4-ylphenyl)-1-phenylethanone
CID 22052973
2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
CID 57110605
4-(4-benzylphenyl)morpholine
CID 11514364
2,2-bis(methylamino)-1-(4-morpholin-4-ylphenyl)-4-phenylbutan-1-one
CID 174831575
1-(4-benzylpiperazin-1-yl)-2-(4-morpholin-4-ylphenyl)ethanone
CID 110411980
2-(4-morpholin-4-ylbenzoyl)benzoic acid
CID 20536938
1-[4-[4-(4-morpholin-4-ylphenyl)piperazin-1-yl]phenyl]ethanone
CID 20729332
2-benzyl-2-[dimethyl(trimethylsilyl)silyl]oxy-1-(4-morpholin-4-ylphenyl)butan-1-one
CID 164713973
2-(dimethylamino)-1-(4-morpholin-4-ylphenyl)butan-1-one;1-(4-morpholin-4-ylphenyl)-2-phenylethanone
CID 90024820
N-(2,2-dimethylpropyl)-4-morpholin-4-ylbenzamide
CID 110474046
4-amino-2,2-dimethyl-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
CID 68890716
2-amino-4,4-dimethyl-1-(4-morpholin-4-ylphenyl)-5-phenylpentan-1-one
CID 57126058

Frequently Asked Questions

What is the IUPAC name of [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone?
The IUPAC name of [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone (CID 174435606) is [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone.
What is the SMILES notation for [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone?
The canonical SMILES for [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone is C[Sn](C)(Cc1ccccc1)C(=O)c1ccc(N2CCOCC2)cc1.
What is the InChIKey of [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone?
The InChIKey is LBWDLDNDXSABED-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12NO2.C7H7.2CH3.Sn/c13-9-10-1-3-11(4-2-10)12-5-7-14-8-6-12;1-7-5-3-2-4-6-7;;;/h1-4H,5-8H2;2-6H,1H2;2*1H3;.
What are the key properties of [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone?
[benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone has a molecular weight of 430.14 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [benzyl(dimethyl)stannyl]-(4-morpholin-4-ylphenyl)methanone is sourced from PubChem (CID 174435606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).