1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine

C13H16N2S — CID 79975756

IUPAC1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine
SMILESCCc1ccsc1C(N)Cc1ccccn1
InChIInChI=1S/C13H16N2S/c1-2-10-6-8-16-13(10)12(14)9-11-5-3-4-7-15-11/h3-8,12H,2,9,14H2,1H3
InChIKeyVUUNJXUVRCQSDN-UHFFFAOYSA-N
MW232.35 g/mol
LogP2.95
Rot. Bonds4

About 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine

1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine (PubChem CID 79975756) has the molecular formula C13H16N2S and a molecular weight of 232.35 g/mol. Its IUPAC name is 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine.

Molecular Properties

Compound Name1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine
PubChem CID79975756
Molecular FormulaC13H16N2S
Molecular Weight232.35 g/mol
Exact Mass232.10
IUPAC Name1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine
SMILESCCc1ccsc1C(N)Cc1ccccn1
InChIInChI=1S/C13H16N2S/c1-2-10-6-8-16-13(10)12(14)9-11-5-3-4-7-15-11/h3-8,12H,2,9,14H2,1H3
InChIKeyVUUNJXUVRCQSDN-UHFFFAOYSA-N
XLogP2.95
TPSA38.91 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

2-[2-chloro-2-(3-ethylthiophen-2-yl)ethyl]pyridine
CID 79975627
1-(3-ethyl-2-pyridinyl)-2-pyridin-2-ylethanamine
CID 82729615
1-(3-ethylthiophen-2-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 104996976
2-(1-butan-2-ylpyrazol-3-yl)-1-(3-ethylthiophen-2-yl)ethanamine
CID 104989680
2-(1,3-diethylpyrazol-5-yl)-1-(3-ethylthiophen-2-yl)ethanamine
CID 105001574
(2S)-1-pyridin-2-ylpropan-2-amine
CID 42037572
2-amino-3-pyridin-2-ylpropanal
CID 22556784
1-(3-ethylthiophen-2-yl)hexan-1-amine
CID 115837119
1-(3-ethylthiophen-2-yl)-2-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]ethanamine
CID 104999929
1-(3-ethylthiophen-2-yl)-2-(3-methoxyphenyl)ethanamine
CID 79975339
1-(3-ethylthiophen-2-yl)-4,4-dimethylpentan-1-amine
CID 115849809
2-cyclobutyl-1-(3-ethylthiophen-2-yl)ethanamine
CID 115863467

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine?
The IUPAC name of 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine (CID 79975756) is 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine.
What is the SMILES notation for 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine?
The canonical SMILES for 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine is CCc1ccsc1C(N)Cc1ccccn1.
What is the InChIKey of 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine?
The InChIKey is VUUNJXUVRCQSDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2S/c1-2-10-6-8-16-13(10)12(14)9-11-5-3-4-7-15-11/h3-8,12H,2,9,14H2,1H3.
What are the key properties of 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine?
1-(3-ethylthiophen-2-yl)-2-pyridin-2-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 1-(3-ethylthiophen-2-yl)-2-pyridin-2-ylethanamine is sourced from PubChem (CID 79975756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).