N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine

C13H16N2S — CID 62601722

IUPACN-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine
SMILESCNC(Cc1ccsc1)Cc1ccccn1
InChIInChI=1S/C13H16N2S/c1-14-13(8-11-5-7-16-10-11)9-12-4-2-3-6-15-12/h2-7,10,13-14H,8-9H2,1H3
InChIKeyMGZQRTQRMNGGPA-UHFFFAOYSA-N
MW232.35 g/mol
LogP2.52
Rot. Bonds5

About N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine

N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine (PubChem CID 62601722) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine
PubChem CID62601722
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC NameN-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine
SMILESCNC(Cc1ccsc1)Cc1ccccn1
InChIInChI=1S/C13H16N2S/c1-14-13(8-11-5-7-16-10-11)9-12-4-2-3-6-15-12/h2-7,10,13-14H,8-9H2,1H3
InChIKeyMGZQRTQRMNGGPA-UHFFFAOYSA-N
XLogP2.52
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chlorophenyl)-N-methyl-3-pyridin-2-ylpropan-2-amine
CID 54919483
N-methyl-1-(1-propan-2-ylpyrazol-3-yl)-3-thiophen-3-ylpropan-2-amine
CID 105154784
N-methyl-4-phenyl-1-thiophen-3-ylbutan-2-amine
CID 61078547
1-(2,6-dichlorophenyl)-N-methyl-3-thiophen-3-ylpropan-2-amine
CID 62604150
N-methyl-1-methylsulfanyl-3-thiophen-3-ylpropan-2-amine
CID 62694241
1-(1,3-benzothiazol-2-yl)-N-methyl-3-thiophen-3-ylpropan-2-amine
CID 105169666
1-(3-chlorophenyl)-N-methyl-3-thiophen-3-ylpropan-2-amine
CID 55095443
(1-pyridin-2-yl-5-thiophen-3-ylpentan-3-yl)hydrazine
CID 105306797
1-(1,3-benzothiazol-2-yl)-N-methyl-3-pyridin-2-ylpropan-2-amine
CID 79818939
N-methyl-1-propan-2-ylsulfanyl-3-thiophen-3-ylpropan-2-amine
CID 65132227
N-methyl-1-(3-methyl-2-pyridinyl)-2-thiophen-3-ylethanamine
CID 62603185
1-(1-cyclopentylpyrazol-3-yl)-N-methyl-3-thiophen-3-ylpropan-2-amine
CID 105157011

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine?
The IUPAC name of N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine (CID 62601722) is N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine.
What is the SMILES notation for N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine?
The canonical SMILES for N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine is CNC(Cc1ccsc1)Cc1ccccn1.
What is the InChIKey of N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine?
The InChIKey is MGZQRTQRMNGGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2S/c1-14-13(8-11-5-7-16-10-11)9-12-4-2-3-6-15-12/h2-7,10,13-14H,8-9H2,1H3.
What are the key properties of N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine?
N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine has a molecular weight of 232.35 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyridin-2-yl-3-thiophen-3-ylpropan-2-amine is sourced from PubChem (CID 62601722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).