(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine

C12H14N2S — CID 115854886

IUPAC(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine
SMILESCc1ccc(C(N)c2sccc2C)cn1
InChIInChI=1S/C12H14N2S/c1-8-5-6-15-12(8)11(13)10-4-3-9(2)14-7-10/h3-7,11H,13H2,1-2H3
InChIKeyBOUKOQDGIFRPPY-UHFFFAOYSA-N
MW218.32 g/mol
LogP2.81
Rot. Bonds2

About (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine

(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine (PubChem CID 115854886) has the molecular formula C12H14N2S and a molecular weight of 218.32 g/mol. Its IUPAC name is (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine.

Molecular Properties

Compound Name(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine
PubChem CID115854886
Molecular FormulaC12H14N2S
Molecular Weight218.32 g/mol
Exact Mass218.09
IUPAC Name(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine
SMILESCc1ccc(C(N)c2sccc2C)cn1
InChIInChI=1S/C12H14N2S/c1-8-5-6-15-12(8)11(13)10-4-3-9(2)14-7-10/h3-7,11H,13H2,1-2H3
InChIKeyBOUKOQDGIFRPPY-UHFFFAOYSA-N
XLogP2.81
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methylthiophen-2-yl)-pyridin-3-ylmethanamine
CID 78973972
(3-methylthiophen-2-yl)-pyrimidin-5-ylmethanamine
CID 115827446
(3-methylthiophen-2-yl)-(1H-pyrazol-4-yl)methanamine
CID 82236060
(6-methyl-3-pyridinyl)-(4-propan-2-ylphenyl)methanamine
CID 55164666
(3-methylthiophen-2-yl)-pyridin-2-ylmethanamine
CID 79989254
2,3-dihydro-1H-inden-5-yl-(3-methylthiophen-2-yl)methanamine
CID 43464476
3-[amino-(3-methylthiophen-2-yl)methyl]aniline
CID 116936643
(3-fluoro-4-methylphenyl)-(6-methyl-3-pyridinyl)methanamine
CID 63156098
(6-methyl-3-pyridinyl)-(thiadiazol-5-yl)methanamine
CID 105146287
(6-methyl-3-pyridinyl)-(1,2,5-thiadiazol-3-yl)methanamine
CID 105146258
(2-methylpyrimidin-4-yl)-(3-methylthiophen-2-yl)methanamine
CID 115530132
(3,5-dichlorophenyl)-(6-methyl-3-pyridinyl)methanamine
CID 115854907

Frequently Asked Questions

What is the IUPAC name of (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine?
The IUPAC name of (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine (CID 115854886) is (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine.
What is the SMILES notation for (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine?
The canonical SMILES for (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine is Cc1ccc(C(N)c2sccc2C)cn1.
What is the InChIKey of (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine?
The InChIKey is BOUKOQDGIFRPPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-8-5-6-15-12(8)11(13)10-4-3-9(2)14-7-10/h3-7,11H,13H2,1-2H3.
What are the key properties of (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine?
(6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine has a molecular weight of 218.32 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methyl-3-pyridinyl)-(3-methylthiophen-2-yl)methanamine is sourced from PubChem (CID 115854886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).