2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine

C12H16N2S2 — CID 103714662

IUPAC2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine
SMILESCC(C)(NCCc1ccsc1)c1nccs1
InChIInChI=1S/C12H16N2S2/c1-12(2,11-13-6-8-16-11)14-5-3-10-4-7-15-9-10/h4,6-9,14H,3,5H2,1-2H3
InChIKeyZVRAPIKLQMDKSV-UHFFFAOYSA-N
MW252.41 g/mol
LogP3.27
Rot. Bonds5

About 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine

2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine (PubChem CID 103714662) has the molecular formula C12H16N2S2 and a molecular weight of 252.41 g/mol. Its IUPAC name is 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine.

Molecular Properties

Compound Name2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine
PubChem CID103714662
Molecular FormulaC12H16N2S2
Molecular Weight252.41 g/mol
Exact Mass252.08
IUPAC Name2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine
SMILESCC(C)(NCCc1ccsc1)c1nccs1
InChIInChI=1S/C12H16N2S2/c1-12(2,11-13-6-8-16-11)14-5-3-10-4-7-15-9-10/h4,6-9,14H,3,5H2,1-2H3
InChIKeyZVRAPIKLQMDKSV-UHFFFAOYSA-N
XLogP3.27
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.41
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[2-(1,3-thiazol-2-yl)propan-2-ylamino]hexan-1-ol
CID 103738697
2,2,3-trimethyl-3-(2-thiophen-3-ylethylamino)butanoic acid
CID 65264366
4-[[2-(1,3-thiazol-2-yl)propan-2-ylamino]methyl]aniline
CID 114132033
N-(3-methylsulfonylpropyl)-2-(1,3-thiazol-2-yl)propan-2-amine
CID 71986823
N-[2-(2-methoxyethoxy)ethyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 103738822
2-(hydroxymethyl)-2-(2-thiophen-3-ylethylamino)propane-1,3-diol
CID 107852268
N-methyl-3-[2-(1,3-thiazol-2-yl)propan-2-ylamino]propane-1-sulfonamide
CID 71986830
N-[(2-methylphenyl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 113237093
N-[2-(3-bromophenoxy)ethyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 103714667
4-[[2-(1,3-thiazol-2-yl)propan-2-ylamino]methyl]benzene-1,2,3-triol
CID 103953465
N-[(5-methyl-2-pyridinyl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 113258267
N-[(5-chlorofuran-2-yl)methyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 115630853

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine?
The IUPAC name of 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine (CID 103714662) is 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine.
What is the SMILES notation for 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine?
The canonical SMILES for 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine is CC(C)(NCCc1ccsc1)c1nccs1.
What is the InChIKey of 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine?
The InChIKey is ZVRAPIKLQMDKSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S2/c1-12(2,11-13-6-8-16-11)14-5-3-10-4-7-15-9-10/h4,6-9,14H,3,5H2,1-2H3.
What are the key properties of 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine?
2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine has a molecular weight of 252.41 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-2-yl)-N-(2-thiophen-3-ylethyl)propan-2-amine is sourced from PubChem (CID 103714662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).