1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine

C11H11FN2S — CID 62543515

IUPAC1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2cccc(F)c2)cs1
InChIInChI=1S/C11H11FN2S/c1-13-6-11-14-10(7-15-11)8-3-2-4-9(12)5-8/h2-5,7,13H,6H2,1H3
InChIKeyWVFYTLFBFBVQAY-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.67
Rot. Bonds3

About 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine

1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine (PubChem CID 62543515) has the molecular formula C11H11FN2S and a molecular weight of 222.29 g/mol. Its IUPAC name is 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
PubChem CID62543515
Molecular FormulaC11H11FN2S
Molecular Weight222.29 g/mol
Exact Mass222.06
IUPAC Name1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2cccc(F)c2)cs1
InChIInChI=1S/C11H11FN2S/c1-13-6-11-14-10(7-15-11)8-3-2-4-9(12)5-8/h2-5,7,13H,6H2,1H3
InChIKeyWVFYTLFBFBVQAY-UHFFFAOYSA-N
XLogP2.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylbutan-1-amine
CID 116968174
2-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N,2-dimethylpropan-1-amine
CID 116865445
N-methyl-1-[4-(4-methylphenyl)-1,3-thiazol-2-yl]methanamine
CID 4660258
1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 83119834
4-(3-fluorophenyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 9420037
4-(3-fluorophenyl)-N-propan-2-yl-1,3-thiazol-2-amine
CID 60675825
1-[3-(3-fluorophenyl)-1H-pyrazol-5-yl]-N-methylmethanamine
CID 62111510
1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-2-methylpropan-1-amine
CID 61337834
4-[2-(methylaminomethyl)-1,3-thiazol-4-yl]-N-phenylaniline;hydrochloride
CID 67215069
3-[2-[(3-fluorophenyl)sulfanylmethyl]-1,3-thiazol-4-yl]aniline
CID 66073148
1-[4-(3-chloro-4-methoxyphenyl)-1,3-thiazol-2-yl]-N-methylmethanamine
CID 3299476
[4-(3-fluorophenyl)-1,3-thiazol-2-yl]methyl-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium
CID 9232025

Frequently Asked Questions

What is the IUPAC name of 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine (CID 62543515) is 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine is CNCc1nc(-c2cccc(F)c2)cs1.
What is the InChIKey of 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The InChIKey is WVFYTLFBFBVQAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2S/c1-13-6-11-14-10(7-15-11)8-3-2-4-9(12)5-8/h2-5,7,13H,6H2,1H3.
What are the key properties of 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine has a molecular weight of 222.29 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-N-methylmethanamine is sourced from PubChem (CID 62543515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).