4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine

C10H14N4S — CID 62962265

IUPAC4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCCc1csc(NCc2cnn(C)c2)n1
InChIInChI=1S/C10H14N4S/c1-3-9-7-15-10(13-9)11-4-8-5-12-14(2)6-8/h5-7H,3-4H2,1-2H3,(H,11,13)
InChIKeyFSPNOBFTKQZVKK-UHFFFAOYSA-N
MW222.32 g/mol
LogP2.05
Rot. Bonds4

About 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine

4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine (PubChem CID 62962265) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine
PubChem CID62962265
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine
SMILESCCc1csc(NCc2cnn(C)c2)n1
InChIInChI=1S/C10H14N4S/c1-3-9-7-15-10(13-9)11-4-8-5-12-14(2)6-8/h5-7H,3-4H2,1-2H3,(H,11,13)
InChIKeyFSPNOBFTKQZVKK-UHFFFAOYSA-N
XLogP2.05
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-[(1-methylpyrazol-4-yl)methylamino]-1,3-thiazol-4-yl]acetic acid
CID 80575860
5-methyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3,4-thiadiazol-2-amine
CID 64915771
N-[(1,3-dimethylpyrazol-4-yl)methyl]-4-ethyl-1,3-thiazol-2-amine
CID 112670751
ethyl 3-[2-[2-(1-methylpyrazol-4-yl)ethylamino]-1,3-thiazol-4-yl]propanoate
CID 103488217
4-ethyl-2-(1-methylpyrazol-4-yl)-1,3-thiazole
CID 115662825
4-ethyl-N-(2H-tetrazol-5-ylmethyl)-1,3-thiazol-2-amine
CID 62962458
N-[(4-fluorophenyl)methyl]-4-(1-methylpyrazol-4-yl)-1,3-thiazol-2-amine
CID 99697962
3-cyclopropyl-N-[(1-methylpyrazol-4-yl)methyl]-1,2,4-thiadiazol-5-amine
CID 65276713
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-1-methylpyrazol-4-amine
CID 78921412
4-ethyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-2-amine
CID 62963186
2-ethyl-N-[(1-methylpyrazol-4-yl)methyl]aniline
CID 28600445
ethane;4-ethyl-1-methylpyrazole
CID 143829284

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
The IUPAC name of 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine (CID 62962265) is 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine.
What is the SMILES notation for 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
The canonical SMILES for 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine is CCc1csc(NCc2cnn(C)c2)n1.
What is the InChIKey of 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
The InChIKey is FSPNOBFTKQZVKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-3-9-7-15-10(13-9)11-4-8-5-12-14(2)6-8/h5-7H,3-4H2,1-2H3,(H,11,13).
What are the key properties of 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine?
4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine has a molecular weight of 222.32 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-1,3-thiazol-2-amine is sourced from PubChem (CID 62962265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).