N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine

C14H19N3S — CID 105073508

IUPACN-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
SMILESCCN(Cc1cccs1)c1cnccc1CNC
InChIInChI=1S/C14H19N3S/c1-3-17(11-13-5-4-8-18-13)14-10-16-7-6-12(14)9-15-2/h4-8,10,15H,3,9,11H2,1-2H3
InChIKeyYQIGUFXUKHUUCX-UHFFFAOYSA-N
MW261.39 g/mol
LogP2.89
Rot. Bonds6

About N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine

N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine (PubChem CID 105073508) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine.

Molecular Properties

Compound NameN-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
PubChem CID105073508
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC NameN-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
SMILESCCN(Cc1cccs1)c1cnccc1CNC
InChIInChI=1S/C14H19N3S/c1-3-17(11-13-5-4-8-18-13)14-10-16-7-6-12(14)9-15-2/h4-8,10,15H,3,9,11H2,1-2H3
InChIKeyYQIGUFXUKHUUCX-UHFFFAOYSA-N
XLogP2.89
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-(methylaminomethyl)-N-(pyridin-4-ylmethyl)pyridin-3-amine
CID 105073292
N-cyclopropyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105073669
N-cyclopropyl-3-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81247478
N-ethyl-5-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine
CID 107379721
N-propan-2-yl-4-(propylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105073477
N-ethyl-2-(propylaminomethyl)-N-(thiophen-2-ylmethyl)aniline
CID 61437944
[3-[methyl(thiophen-2-ylmethyl)amino]-4-pyridinyl]methanol
CID 105066711
N-ethyl-4-(methylaminomethyl)-N-(2-methylphenyl)pyridin-3-amine
CID 105072688
N-methyl-3-(propylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81249546
4-(chloromethyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-3-amine
CID 105067372
2-N-ethyl-2-N-(thiophen-2-ylmethyl)benzene-1,2-diamine
CID 61437146
3-(ethylaminomethyl)-N-propan-2-yl-N-(thiophen-2-ylmethyl)pyridin-4-amine
CID 81246160

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine?
The IUPAC name of N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine (CID 105073508) is N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine.
What is the SMILES notation for N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine?
The canonical SMILES for N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine is CCN(Cc1cccs1)c1cnccc1CNC.
What is the InChIKey of N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine?
The InChIKey is YQIGUFXUKHUUCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-3-17(11-13-5-4-8-18-13)14-10-16-7-6-12(14)9-15-2/h4-8,10,15H,3,9,11H2,1-2H3.
What are the key properties of N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine?
N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine has a molecular weight of 261.39 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(methylaminomethyl)-N-(thiophen-2-ylmethyl)pyridin-3-amine is sourced from PubChem (CID 105073508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).