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

C13H21N5OS — CID 106038137

IUPAC5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCOc1nc(N(C)C)sc1CNCc1cnn(C)c1C
InChIInChI=1S/C13H21N5OS/c1-9-10(7-15-18(9)4)6-14-8-11-12(19-5)16-13(20-11)17(2)3/h7,14H,6,8H2,1-5H3
InChIKeyIEHISFBVTGQAHJ-UHFFFAOYSA-N
MW295.41 g/mol
LogP1.55
Rot. Bonds6

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

5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine (PubChem CID 106038137) has the molecular formula C13H21N5OS and a molecular weight of 295.41 g/mol. Its IUPAC name is 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
PubChem CID106038137
Molecular FormulaC13H21N5OS
Molecular Weight295.41 g/mol
Exact Mass295.15
IUPAC Name5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
SMILESCOc1nc(N(C)C)sc1CNCc1cnn(C)c1C
InChIInChI=1S/C13H21N5OS/c1-9-10(7-15-18(9)4)6-14-8-11-12(19-5)16-13(20-11)17(2)3/h7,14H,6,8H2,1-5H3
InChIKeyIEHISFBVTGQAHJ-UHFFFAOYSA-N
XLogP1.55
TPSA55.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine with MolForge

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Related Compounds

4-methoxy-N,N-dimethyl-5-[[(3-methylphenyl)methylamino]methyl]-1,3-thiazol-2-amine
CID 43433391
5-[(2,3-dimethylbutylamino)methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 64569644
4-methoxy-N,N-dimethyl-5-[[(2,2,3,3-tetramethylcyclopropyl)methylamino]methyl]-1,3-thiazol-2-amine
CID 79352826
N-[(1,5-dimethylpyrazol-4-yl)methyl]-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 103858301
5-[(ethoxyamino)methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 82710285
5-[[(1,4-dimethylpiperazin-2-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 63896681
3-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methylamino]-N,N-diethylpropanamide
CID 60925601
1-N-[[2-(dimethylamino)-4-methoxy-1,3-thiazol-5-yl]methyl]-4-N,4-N-dimethylbenzene-1,4-diamine
CID 43665272
4-methoxy-N,N-dimethyl-5-[[(2,2,3,3-tetramethylcyclopropyl)amino]methyl]-1,3-thiazol-2-amine
CID 79358881
1-(2,3-dimethoxyphenyl)-N-[(1,5-dimethylpyrazol-4-yl)methyl]methanamine
CID 19623107
1-(2,4-dimethoxyphenyl)-N-[(1,5-dimethylpyrazol-4-yl)methyl]methanamine
CID 19623111
5-[(3-fluoro-5-methylanilino)methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine
CID 79055525

Frequently Asked Questions

What is the IUPAC name of 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine (CID 106038137) is 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine is COc1nc(N(C)C)sc1CNCc1cnn(C)c1C.
What is the InChIKey of 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine?
The InChIKey is IEHISFBVTGQAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5OS/c1-9-10(7-15-18(9)4)6-14-8-11-12(19-5)16-13(20-11)17(2)3/h7,14H,6,8H2,1-5H3.
What are the key properties of 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine?
5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine has a molecular weight of 295.41 g/mol, XLogP of 1.55, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(1,5-dimethylpyrazol-4-yl)methylamino]methyl]-4-methoxy-N,N-dimethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 106038137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).