6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine

C10H15FN2S — CID 115663512

IUPAC6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine
SMILESCSC(C)(C)CNc1cccc(F)n1
InChIInChI=1S/C10H15FN2S/c1-10(2,14-3)7-12-9-6-4-5-8(11)13-9/h4-6H,7H2,1-3H3,(H,12,13)
InChIKeyAFFXDMISOPRYTC-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.77
Rot. Bonds4

About 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine

6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine (PubChem CID 115663512) has the molecular formula C10H15FN2S and a molecular weight of 214.31 g/mol. Its IUPAC name is 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine
PubChem CID115663512
Molecular FormulaC10H15FN2S
Molecular Weight214.31 g/mol
Exact Mass214.09
IUPAC Name6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine
SMILESCSC(C)(C)CNc1cccc(F)n1
InChIInChI=1S/C10H15FN2S/c1-10(2,14-3)7-12-9-6-4-5-8(11)13-9/h4-6H,7H2,1-3H3,(H,12,13)
InChIKeyAFFXDMISOPRYTC-UHFFFAOYSA-N
XLogP2.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-N-(2-methoxy-2-methylpropyl)pyridin-2-amine
CID 115658515
3-[(6-fluoro-2-pyridinyl)amino]-2-methylpropane-1,2-diol
CID 66169557
5-[(6-fluoro-2-pyridinyl)amino]-4,4-dimethylpentan-1-ol
CID 103895914
1-[(6-fluoro-2-pyridinyl)amino]-2-(furan-2-yl)propan-2-ol
CID 133323859
2-methyl-N-[[6-[[(2-methyl-2-methylsulfanylpropyl)amino]methyl]-2-pyridinyl]methyl]-2-methylsulfanylpropan-1-amine
CID 20679715
N-(6-fluoro-2-pyridinyl)-N',N'-dimethylethane-1,2-diamine
CID 61229371
N-(2,3-dimethylbutyl)-6-fluoropyridin-2-amine
CID 64597219
N-(2-ethylbutyl)-6-fluoropyridin-2-amine
CID 75355438
6-fluoro-N-prop-2-enylpyridin-2-amine
CID 103624863
N-(3-ethylsulfanylpropyl)-6-fluoropyridin-2-amine
CID 116812922
6-fluoro-N-pent-3-ynylpyridin-2-amine
CID 106196296
6-fluoro-N-methylpyridin-2-amine;dihydrochloride
CID 175106900

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine?
The IUPAC name of 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine (CID 115663512) is 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine.
What is the SMILES notation for 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine?
The canonical SMILES for 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine is CSC(C)(C)CNc1cccc(F)n1.
What is the InChIKey of 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine?
The InChIKey is AFFXDMISOPRYTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2S/c1-10(2,14-3)7-12-9-6-4-5-8(11)13-9/h4-6H,7H2,1-3H3,(H,12,13).
What are the key properties of 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine?
6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine has a molecular weight of 214.31 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-N-(2-methyl-2-methylsulfanylpropyl)pyridin-2-amine is sourced from PubChem (CID 115663512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).