5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine

C10H13FN2S — CID 130485396

IUPAC5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine
SMILESFc1cncc(NCC2CCSC2)c1
InChIInChI=1S/C10H13FN2S/c11-9-3-10(6-12-5-9)13-4-8-1-2-14-7-8/h3,5-6,8,13H,1-2,4,7H2
InChIKeyBVMUULFHCZVART-UHFFFAOYSA-N
MW212.29 g/mol
LogP2.39
Rot. Bonds3

About 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine

5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine (PubChem CID 130485396) has the molecular formula C10H13FN2S and a molecular weight of 212.29 g/mol. Its IUPAC name is 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine.

Molecular Properties

Compound Name5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine
PubChem CID130485396
Molecular FormulaC10H13FN2S
Molecular Weight212.29 g/mol
Exact Mass212.08
IUPAC Name5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine
SMILESFc1cncc(NCC2CCSC2)c1
InChIInChI=1S/C10H13FN2S/c11-9-3-10(6-12-5-9)13-4-8-1-2-14-7-8/h3,5-6,8,13H,1-2,4,7H2
InChIKeyBVMUULFHCZVART-UHFFFAOYSA-N
XLogP2.39
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopentylmethyl)-5-fluoropyridin-3-amine
CID 130164803
N-(thiolan-3-ylmethyl)pyrimidin-5-amine
CID 107588267
1-(5-fluoro-3-pyridinyl)-N-(thiolan-3-ylmethyl)ethanamine
CID 107166794
(3R)-N-(5-fluoro-3-pyridinyl)thiolane-3-carboxamide
CID 129349225
6-fluoro-N-(thiolan-3-ylmethyl)pyrimidin-4-amine
CID 107297717
5-fluoro-N-(thian-4-ylmethyl)pyrimidin-2-amine
CID 115750149
2-bromo-4,6-difluoro-N-(thiolan-3-ylmethyl)aniline
CID 107131387
2-N-(thiolan-3-ylmethyl)pyrimidine-2,5-diamine
CID 107294936
3,4,5-trimethoxy-N-(thiolan-3-ylmethyl)aniline
CID 107131142
4-N-(thiolan-3-ylmethyl)-2-(trifluoromethyl)benzene-1,4-diamine
CID 107294910
6-methylsulfonyl-N-(thiolan-3-ylmethyl)pyridin-3-amine
CID 107131447
3-ethyl-N-(thiolan-3-ylmethyl)aniline
CID 107131230

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine?
The IUPAC name of 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine (CID 130485396) is 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine.
What is the SMILES notation for 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine?
The canonical SMILES for 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine is Fc1cncc(NCC2CCSC2)c1.
What is the InChIKey of 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine?
The InChIKey is BVMUULFHCZVART-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2S/c11-9-3-10(6-12-5-9)13-4-8-1-2-14-7-8/h3,5-6,8,13H,1-2,4,7H2.
What are the key properties of 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine?
5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine has a molecular weight of 212.29 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(thiolan-3-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 130485396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).