N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine

C13H16N2S — CID 62603185

IUPACN-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine
SMILESCNC(Cc1ccsc1)c1ncccc1C
InChIInChI=1S/C13H16N2S/c1-10-4-3-6-15-13(10)12(14-2)8-11-5-7-16-9-11/h3-7,9,12,14H,8H2,1-2H3
InChIKeyMZBZTXQQVIHHBU-UHFFFAOYSA-N
MW232.35 g/mol
LogP2.95
Rot. Bonds4

About N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine

N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine (PubChem CID 62603185) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine.

Molecular Properties

Compound NameN-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine
PubChem CID62603185
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC NameN-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine
SMILESCNC(Cc1ccsc1)c1ncccc1C
InChIInChI=1S/C13H16N2S/c1-10-4-3-6-15-13(10)12(14-2)8-11-5-7-16-9-11/h3-7,9,12,14H,8H2,1-2H3
InChIKeyMZBZTXQQVIHHBU-UHFFFAOYSA-N
XLogP2.95
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-5-[[[(1S)-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethyl]amino]methyl]pyrimidin-2-amine
CID 92562333
N-[(3,4-dimethoxyphenyl)methyl]-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine
CID 46955539
2-imidazol-1-yl-N-[1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethyl]acetamide
CID 110222226
(1S)-1-(3-methyl-2-pyridinyl)-N-[(2-pyrazol-1-ylphenyl)methyl]-2-thiophen-3-ylethanamine
CID 92562330
N-methyl-1-pyridin-3-yl-2-thiophen-3-ylethanamine
CID 61077665
N-[(1R)-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethyl]-2-(1,2,4-triazol-1-yl)acetamide
CID 92562309
N-ethyl-1-(3-ethyl-2-pyridinyl)-2-thiophen-3-ylethanamine
CID 82730797
N-methyl-1-(3-methyl-2-pyridinyl)-3-thiophen-2-ylpropan-1-amine
CID 55236710
2-(1-benzothiophen-3-yl)-N-methyl-1-(3-methyl-2-pyridinyl)ethanamine
CID 63737255
[1-(3-methyl-2-pyridinyl)-2-pyridin-4-ylethyl]hydrazine
CID 105209330
2-[(1,1-dioxothiolan-3-yl)-methylamino]-N-[1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethyl]acetamide
CID 110222235
N-methyl-1-(3-methyl-2-pyridinyl)pentan-1-amine
CID 62604870

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine?
The IUPAC name of N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine (CID 62603185) is N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine.
What is the SMILES notation for N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine?
The canonical SMILES for N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine is CNC(Cc1ccsc1)c1ncccc1C.
What is the InChIKey of N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine?
The InChIKey is MZBZTXQQVIHHBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2S/c1-10-4-3-6-15-13(10)12(14-2)8-11-5-7-16-9-11/h3-7,9,12,14H,8H2,1-2H3.
What are the key properties of N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine?
N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine has a molecular weight of 232.35 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine is sourced from PubChem (CID 62603185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).