N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine

C12H14N2S — CID 106755405

IUPACN-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine
SMILESCNC(c1ccsc1)c1ccnc(C)c1
InChIInChI=1S/C12H14N2S/c1-9-7-10(3-5-14-9)12(13-2)11-4-6-15-8-11/h3-8,12-13H,1-2H3
InChIKeyCGTYRVSGFGUMMQ-UHFFFAOYSA-N
MW218.32 g/mol
LogP2.76
Rot. Bonds3

About N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine

N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine (PubChem CID 106755405) has the molecular formula C12H14N2S and a molecular weight of 218.32 g/mol. Its IUPAC name is N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine
PubChem CID106755405
Molecular FormulaC12H14N2S
Molecular Weight218.32 g/mol
Exact Mass218.09
IUPAC NameN-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine
SMILESCNC(c1ccsc1)c1ccnc(C)c1
InChIInChI=1S/C12H14N2S/c1-9-7-10(3-5-14-9)12(13-2)11-4-6-15-8-11/h3-8,12-13H,1-2H3
InChIKeyCGTYRVSGFGUMMQ-UHFFFAOYSA-N
XLogP2.76
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,6-dimethylpyridazin-4-yl)-N-methyl-1-thiophen-3-ylmethanamine
CID 105153970
1-(3-bromofuran-2-yl)-N-methyl-1-(2-methyl-4-pyridinyl)methanamine
CID 106755358
1-(3,4-dimethoxyphenyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 43481131
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-methyl-1-(2-methyl-4-pyridinyl)methanamine
CID 106755205
N-methyl-1-(2-methyl-4-pyridinyl)-1-quinolin-7-ylmethanamine
CID 106755701
N-methyl-1-(7-methyl-1-benzofuran-2-yl)-1-(2-methyl-4-pyridinyl)methanamine
CID 106755900
1-(5-fluoro-2-methylphenyl)-N-methyl-1-(2-methyl-4-pyridinyl)methanamine
CID 106755234
1-(3-chloro-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 103444122
1-(cyclohexen-1-yl)-N-methyl-1-(2-methyl-4-pyridinyl)methanamine
CID 106756069
1-[3-fluoro-4-(trifluoromethyl)phenyl]-N-methyl-1-thiophen-3-ylmethanamine
CID 107288767
1-[4-fluoro-3-(trifluoromethyl)phenyl]-N-methyl-1-thiophen-3-ylmethanamine
CID 104988381
1-(3-ethyl-2-pyridinyl)-N-methyl-1-thiophen-3-ylmethanamine
CID 82730091

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine?
The IUPAC name of N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine (CID 106755405) is N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine.
What is the SMILES notation for N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine?
The canonical SMILES for N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine is CNC(c1ccsc1)c1ccnc(C)c1.
What is the InChIKey of N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine?
The InChIKey is CGTYRVSGFGUMMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2S/c1-9-7-10(3-5-14-9)12(13-2)11-4-6-15-8-11/h3-8,12-13H,1-2H3.
What are the key properties of N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine?
N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine has a molecular weight of 218.32 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyl-4-pyridinyl)-1-thiophen-3-ylmethanamine is sourced from PubChem (CID 106755405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).