1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine

C14H18N2S — CID 66446223

IUPAC1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine
SMILESCCc1ccc(C(N)C(C)c2ccccn2)s1
InChIInChI=1S/C14H18N2S/c1-3-11-7-8-13(17-11)14(15)10(2)12-6-4-5-9-16-12/h4-10,14H,3,15H2,1-2H3
InChIKeyHEXWESUHIQADHF-UHFFFAOYSA-N
MW246.38 g/mol
LogP3.51
Rot. Bonds4

About 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine

1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine (PubChem CID 66446223) has the molecular formula C14H18N2S and a molecular weight of 246.38 g/mol. Its IUPAC name is 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine
PubChem CID66446223
Molecular FormulaC14H18N2S
Molecular Weight246.38 g/mol
Exact Mass246.12
IUPAC Name1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine
SMILESCCc1ccc(C(N)C(C)c2ccccn2)s1
InChIInChI=1S/C14H18N2S/c1-3-11-7-8-13(17-11)14(15)10(2)12-6-4-5-9-16-12/h4-10,14H,3,15H2,1-2H3
InChIKeyHEXWESUHIQADHF-UHFFFAOYSA-N
XLogP3.51
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(5-ethylthiophen-2-yl)ethyl]-1-pyridin-2-ylethanamine
CID 61333360
(3R)-3-pyridin-2-ylbutan-2-amine
CID 140704268
1-(2-iodophenyl)-2-pyridin-2-ylpropan-1-amine
CID 66448363
1-(5-ethylthiophen-2-yl)-2-phenylbutan-1-amine
CID 43104997
1-(4-methoxythiophen-2-yl)-2-pyridin-2-ylpropan-1-amine
CID 81122666
3-pyridin-2-ylbutane-1,2-diamine
CID 67591241
1-(4-methylphenyl)-2-pyridin-2-ylpropan-1-amine
CID 66446811
2-pyridin-2-ylnonan-3-amine
CID 114753071
(1R,2S)-1-pyridin-2-ylpropane-1,2-diamine
CID 131142947
1-(4-fluorophenyl)-2-pyridin-2-ylpropan-1-amine
CID 66446030
2-[(2R)-3-methylbutan-2-yl]pyridine
CID 26793118
1-[(5-ethylthiophen-2-yl)-pyridin-2-ylmethyl]piperidine-2-carboxylic acid
CID 3979426

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine (CID 66446223) is 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine is CCc1ccc(C(N)C(C)c2ccccn2)s1.
What is the InChIKey of 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine?
The InChIKey is HEXWESUHIQADHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2S/c1-3-11-7-8-13(17-11)14(15)10(2)12-6-4-5-9-16-12/h4-10,14H,3,15H2,1-2H3.
What are the key properties of 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine?
1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine has a molecular weight of 246.38 g/mol, XLogP of 3.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylthiophen-2-yl)-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 66446223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).