1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine

C10H10FN3S — CID 83119834

IUPAC1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ccc(F)cn2)cs1
InChIInChI=1S/C10H10FN3S/c1-12-5-10-14-9(6-15-10)8-3-2-7(11)4-13-8/h2-4,6,12H,5H2,1H3
InChIKeyNOXPAIXUNVDLCM-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.06
Rot. Bonds3

About 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine

1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine (PubChem CID 83119834) has the molecular formula C10H10FN3S and a molecular weight of 223.28 g/mol. Its IUPAC name is 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine
PubChem CID83119834
Molecular FormulaC10H10FN3S
Molecular Weight223.28 g/mol
Exact Mass223.06
IUPAC Name1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine
SMILESCNCc1nc(-c2ccc(F)cn2)cs1
InChIInChI=1S/C10H10FN3S/c1-12-5-10-14-9(6-15-10)8-3-2-7(11)4-13-8/h2-4,6,12H,5H2,1H3
InChIKeyNOXPAIXUNVDLCM-UHFFFAOYSA-N
XLogP2.06
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine (CID 83119834) is 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine is CNCc1nc(-c2ccc(F)cn2)cs1.
What is the InChIKey of 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
The InChIKey is NOXPAIXUNVDLCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3S/c1-12-5-10-14-9(6-15-10)8-3-2-7(11)4-13-8/h2-4,6,12H,5H2,1H3.
What are the key properties of 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine?
1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine has a molecular weight of 223.28 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(5-fluoro-2-pyridinyl)-1,3-thiazol-2-yl]-N-methylmethanamine is sourced from PubChem (CID 83119834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).