5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine

C13H17N3S — CID 79470640

IUPAC5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine
SMILESCN(CCc1cccs1)c1ccc(CN)cn1
InChIInChI=1S/C13H17N3S/c1-16(7-6-12-3-2-8-17-12)13-5-4-11(9-14)10-15-13/h2-5,8,10H,6-7,9,14H2,1H3
InChIKeyPCXJYARHWVFQCP-UHFFFAOYSA-N
MW247.37 g/mol
LogP2.28
Rot. Bonds5

About 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine

5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine (PubChem CID 79470640) has the molecular formula C13H17N3S and a molecular weight of 247.37 g/mol. Its IUPAC name is 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine
PubChem CID79470640
Molecular FormulaC13H17N3S
Molecular Weight247.37 g/mol
Exact Mass247.11
IUPAC Name5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine
SMILESCN(CCc1cccs1)c1ccc(CN)cn1
InChIInChI=1S/C13H17N3S/c1-16(7-6-12-3-2-8-17-12)13-5-4-11(9-14)10-15-13/h2-5,8,10H,6-7,9,14H2,1H3
InChIKeyPCXJYARHWVFQCP-UHFFFAOYSA-N
XLogP2.28
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.37
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine
CID 79470037
2-N,4-dimethyl-2-N-(2-thiophen-2-ylethyl)pyridine-2,5-diamine
CID 79475919
4-(2-aminoethyl)-N-methyl-N-(2-thiophen-2-ylethyl)aniline
CID 79493669
5-amino-2-[methyl(2-thiophen-2-ylethyl)amino]pyridine-4-carboxamide
CID 114090453
6-N-methyl-6-N-(2-thiophen-2-ylethyl)pyridine-2,6-diamine
CID 80652044
2-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-4-amine
CID 79470815
5-(2-aminoethyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 80634373
5-bromo-N-methyl-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 55137560
5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)-1,3,4-oxadiazol-2-amine
CID 106963020
6-(chloromethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyrazin-2-amine
CID 79486046
4-(2-aminoethyl)-2-chloro-N-methyl-N-(2-thiophen-2-ylethyl)aniline
CID 81166020
5-chloro-N-methyl-4-(methylaminomethyl)-N-(2-thiophen-2-ylethyl)pyridin-2-amine
CID 114926750

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
The IUPAC name of 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine (CID 79470640) is 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
The canonical SMILES for 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine is CN(CCc1cccs1)c1ccc(CN)cn1.
What is the InChIKey of 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
The InChIKey is PCXJYARHWVFQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3S/c1-16(7-6-12-3-2-8-17-12)13-5-4-11(9-14)10-15-13/h2-5,8,10H,6-7,9,14H2,1H3.
What are the key properties of 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine?
5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine has a molecular weight of 247.37 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-2-amine is sourced from PubChem (CID 79470640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).