N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine

C15H20N2S — CID 61333360

IUPACN-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine
SMILESCCc1ccc(C(C)NC(C)c2ccccn2)s1
InChIInChI=1S/C15H20N2S/c1-4-13-8-9-15(18-13)12(3)17-11(2)14-7-5-6-10-16-14/h5-12,17H,4H2,1-3H3
InChIKeyLOJGSBACVHSUQC-UHFFFAOYSA-N
MW260.41 g/mol
LogP4.12
Rot. Bonds5

About N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine

N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine (PubChem CID 61333360) has the molecular formula C15H20N2S and a molecular weight of 260.41 g/mol. Its IUPAC name is N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine.

Molecular Properties

Compound NameN-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine
PubChem CID61333360
Molecular FormulaC15H20N2S
Molecular Weight260.41 g/mol
Exact Mass260.13
IUPAC NameN-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine
SMILESCCc1ccc(C(C)NC(C)c2ccccn2)s1
InChIInChI=1S/C15H20N2S/c1-4-13-8-9-15(18-13)12(3)17-11(2)14-7-5-6-10-16-14/h5-12,17H,4H2,1-3H3
InChIKeyLOJGSBACVHSUQC-UHFFFAOYSA-N
XLogP4.12
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-N-[1-(5-ethylthiophen-2-yl)ethyl]-1-phenylethanamine
CID 81351461
1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine
CID 66446223
(3R)-3-[1-(5-ethylthiophen-2-yl)ethylamino]butan-1-ol
CID 103871723
(1R)-1-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 55277214
N-[(1R)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81401489
3-methyl-N-[(1S)-1-pyridin-2-ylethyl]pentan-2-amine
CID 81402254
N-(1-iodoethyl)-1-pyridin-2-ylethanamine
CID 174262770
(2S)-3-methyl-N-[(1R)-1-pyridin-2-ylethyl]butan-2-amine
CID 28648178
N-[1-(5-ethylthiophen-2-yl)ethyl]-1-(4-methoxyphenyl)ethanamine
CID 66241993
1-(2-ethoxyphenyl)-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 81400310
(1R)-1-(3-bromophenyl)-N-[1-(5-ethylthiophen-2-yl)ethyl]ethanamine
CID 81382264
(1S)-1-pyridin-4-yl-N-(1-pyridin-2-ylethyl)ethanamine
CID 81405517

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine?
The IUPAC name of N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine (CID 61333360) is N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine.
What is the SMILES notation for N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine?
The canonical SMILES for N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine is CCc1ccc(C(C)NC(C)c2ccccn2)s1.
What is the InChIKey of N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine?
The InChIKey is LOJGSBACVHSUQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c1-4-13-8-9-15(18-13)12(3)17-11(2)14-7-5-6-10-16-14/h5-12,17H,4H2,1-3H3.
What are the key properties of N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine?
N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine has a molecular weight of 260.41 g/mol, XLogP of 4.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine is sourced from PubChem (CID 61333360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).