3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine

C10H14F2N2S — CID 112675888

IUPAC3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine
SMILESCSCC(C)CNc1ncc(F)cc1F
InChIInChI=1S/C10H14F2N2S/c1-7(6-15-2)4-13-10-9(12)3-8(11)5-14-10/h3,5,7H,4,6H2,1-2H3,(H,13,14)
InChIKeyBGDZLLXEYPQOJN-UHFFFAOYSA-N
MW232.30 g/mol
LogP2.77
Rot. Bonds5

About 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine

3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine (PubChem CID 112675888) has the molecular formula C10H14F2N2S and a molecular weight of 232.30 g/mol. Its IUPAC name is 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine
PubChem CID112675888
Molecular FormulaC10H14F2N2S
Molecular Weight232.30 g/mol
Exact Mass232.08
IUPAC Name3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine
SMILESCSCC(C)CNc1ncc(F)cc1F
InChIInChI=1S/C10H14F2N2S/c1-7(6-15-2)4-13-10-9(12)3-8(11)5-14-10/h3,5,7H,4,6H2,1-2H3,(H,13,14)
InChIKeyBGDZLLXEYPQOJN-UHFFFAOYSA-N
XLogP2.77
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.30
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,5-difluoro-2-pyridinyl)-N',2-dimethylpropane-1,3-diamine
CID 112676237
3,5-difluoro-N-(3-methyl-2-propan-2-ylbutyl)pyridin-2-amine
CID 102913974
1-[(3,5-difluoro-2-pyridinyl)amino]-4,4-dimethylpentan-2-ol
CID 107153237
1-N-(3,5-difluoro-2-pyridinyl)pentane-1,4-diamine
CID 106127704
N-(3,3-difluoropropyl)-3,5-difluoropyridin-2-amine
CID 127013338
3,5-difluoro-N-(2-methylprop-2-enyl)pyridin-2-amine
CID 114617532
3,5-difluoro-N-(4-propan-2-yloxybutyl)pyridin-2-amine
CID 106012540
3,5-difluoro-N-[2-(3-methylbutoxy)ethyl]pyridin-2-amine
CID 112675793
3,5-difluoro-N-[(1-methylsulfanylcyclohexyl)methyl]pyridin-2-amine
CID 114117150
N-(3-chloropropyl)-3,5-difluoropyridin-2-amine
CID 112676550
2-N-(3,5-difluoro-2-pyridinyl)-2,3-dimethylbutane-1,2-diamine
CID 112676247
5-chloro-N-(2-methyl-3-methylsulfanylpropyl)pyrimidin-2-amine
CID 79556217

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine?
The IUPAC name of 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine (CID 112675888) is 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine.
What is the SMILES notation for 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine?
The canonical SMILES for 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine is CSCC(C)CNc1ncc(F)cc1F.
What is the InChIKey of 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine?
The InChIKey is BGDZLLXEYPQOJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N2S/c1-7(6-15-2)4-13-10-9(12)3-8(11)5-14-10/h3,5,7H,4,6H2,1-2H3,(H,13,14).
What are the key properties of 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine?
3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine has a molecular weight of 232.30 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-(2-methyl-3-methylsulfanylpropyl)pyridin-2-amine is sourced from PubChem (CID 112675888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).