N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine

C14H18N2S — CID 105155581

IUPACN-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine
SMILESCNC(CCc1ccccn1)c1csc(C)c1
InChIInChI=1S/C14H18N2S/c1-11-9-12(10-17-11)14(15-2)7-6-13-5-3-4-8-16-13/h3-5,8-10,14-15H,6-7H2,1-2H3
InChIKeyMMMZSTRZTHVMMY-UHFFFAOYSA-N
MW246.38 g/mol
LogP3.34
Rot. Bonds5

About N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine

N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine (PubChem CID 105155581) has the molecular formula C14H18N2S and a molecular weight of 246.38 g/mol. Its IUPAC name is N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound NameN-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine
PubChem CID105155581
Molecular FormulaC14H18N2S
Molecular Weight246.38 g/mol
Exact Mass246.12
IUPAC NameN-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine
SMILESCNC(CCc1ccccn1)c1csc(C)c1
InChIInChI=1S/C14H18N2S/c1-11-9-12(10-17-11)14(15-2)7-6-13-5-3-4-8-16-13/h3-5,8-10,14-15H,6-7H2,1-2H3
InChIKeyMMMZSTRZTHVMMY-UHFFFAOYSA-N
XLogP3.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-(5-methyl-3-pyridinyl)-3-pyridin-2-ylpropan-1-amine
CID 105173940
1-(4-fluoro-3-methylphenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105143030
N-methyl-1-(2-methylphenyl)-3-pyridin-2-ylpropan-1-amine
CID 105094755
1-(4-ethoxyphenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105140831
1-(2,5-dimethylphenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105120431
1-(2-fluoro-4,6-dimethylphenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 106883930
1-(1-benzofuran-2-yl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105184842
N-methyl-1-(5-methylthiophen-3-yl)-2-pyridin-3-ylethanamine
CID 65104741
1-[(1E)-cycloocten-1-yl]-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 106656225
1-(3,5-dimethylphenyl)-N-methyl-2-pyridin-2-ylethanamine
CID 54936986
2-(2-bromophenyl)-N-methyl-1-(5-methylthiophen-3-yl)ethanamine
CID 65105091
1-(5-fluoro-2-methoxyphenyl)-N-methyl-3-pyridin-2-ylpropan-1-amine
CID 105176576

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine?
The IUPAC name of N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine (CID 105155581) is N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine?
The canonical SMILES for N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine is CNC(CCc1ccccn1)c1csc(C)c1.
What is the InChIKey of N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine?
The InChIKey is MMMZSTRZTHVMMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S/c1-11-9-12(10-17-11)14(15-2)7-6-13-5-3-4-8-16-13/h3-5,8-10,14-15H,6-7H2,1-2H3.
What are the key properties of N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine?
N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine has a molecular weight of 246.38 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methylthiophen-3-yl)-3-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 105155581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).