4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine

C15H21N3OS — CID 43433391

IUPAC4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine
SMILESCOc1nc(N(C)C)sc1CNCc1cccc(C)c1
InChIInChI=1S/C15H21N3OS/c1-11-6-5-7-12(8-11)9-16-10-13-14(19-4)17-15(20-13)18(2)3/h5-8,16H,9-10H2,1-4H3
InChIKeySDXUOBWCWCEBTC-UHFFFAOYSA-N
MW291.42 g/mol
LogP2.82
Rot. Bonds6

About 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine

4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine (PubChem CID 43433391) has the molecular formula C15H21N3OS and a molecular weight of 291.42 g/mol. Its IUPAC name is 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine
PubChem CID43433391
Molecular FormulaC15H21N3OS
Molecular Weight291.42 g/mol
Exact Mass291.14
IUPAC Name4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine
SMILESCOc1nc(N(C)C)sc1CNCc1cccc(C)c1
InChIInChI=1S/C15H21N3OS/c1-11-6-5-7-12(8-11)9-16-10-13-14(19-4)17-15(20-13)18(2)3/h5-8,16H,9-10H2,1-4H3
InChIKeySDXUOBWCWCEBTC-UHFFFAOYSA-N
XLogP2.82
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.42
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine 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

4-methoxy-N,N-dimethyl-5-[(2-phenylethylamino)methyl]-1,3-thiazol-2-amine
CID 43665108
5-[[(2-fluorophenyl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 43433376
5-[(3-fluoro-5-methylanilino)methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 79055525
5-[(2,3-dimethylbutylamino)methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 64569644
4-methoxy-N,N-dimethyl-5-[[[(1S)-1-phenylethyl]amino]methyl]-1,3-thiazol-2-amine
CID 81351809
5-[(ethoxyamino)methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 82710285
1-N-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methyl]-2-N,2-N,4-trimethylpentane-1,2-diamine
CID 43665203
4-methoxy-N,N-dimethyl-5-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]-1,3-thiazol-2-amine
CID 79358881
5-[(5-bromo-2-chloroanilino)methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 62915754
tert-butyl N-[2-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]ethyl]-N-ethylcarbamate
CID 113230829
1-(4-methoxyphenyl)-N-[(3-methylphenyl)methyl]methanamine;oxalic acid
CID 17367818
4-methoxy-N,N-dimethyl-5-[(oxolan-2-ylmethylamino)methyl]-1,3-thiazol-2-amine
CID 43665141

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine (CID 43433391) is 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine is COc1nc(N(C)C)sc1CNCc1cccc(C)c1.
What is the InChIKey of 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine?
The InChIKey is SDXUOBWCWCEBTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3OS/c1-11-6-5-7-12(8-11)9-16-10-13-14(19-4)17-15(20-13)18(2)3/h5-8,16H,9-10H2,1-4H3.
What are the key properties of 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine?
4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine has a molecular weight of 291.42 g/mol, XLogP of 2.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 43433391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).