2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide

C13H15N3OS — CID 113279110

IUPAC2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide
SMILESNC(C(=O)NCCc1cccnc1)c1cccs1
InChIInChI=1S/C13H15N3OS/c14-12(11-4-2-8-18-11)13(17)16-7-5-10-3-1-6-15-9-10/h1-4,6,8-9,12H,5,7,14H2,(H,16,17)
InChIKeyIQAQWPWQKTVZLD-UHFFFAOYSA-N
MW261.35 g/mol
LogP1.50
Rot. Bonds5

About 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide

2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide (PubChem CID 113279110) has the molecular formula C13H15N3OS and a molecular weight of 261.35 g/mol. Its IUPAC name is 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound Name2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide
PubChem CID113279110
Molecular FormulaC13H15N3OS
Molecular Weight261.35 g/mol
Exact Mass261.09
IUPAC Name2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide
SMILESNC(C(=O)NCCc1cccnc1)c1cccs1
InChIInChI=1S/C13H15N3OS/c14-12(11-4-2-8-18-11)13(17)16-7-5-10-3-1-6-15-9-10/h1-4,6,8-9,12H,5,7,14H2,(H,16,17)
InChIKeyIQAQWPWQKTVZLD-UHFFFAOYSA-N
XLogP1.50
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-2-phenyl-N-(2-pyridin-3-ylethyl)acetamide
CID 61177946
N-[(2R)-3-methyl-1-oxo-1-(2-pyridin-3-ylethylamino)butan-2-yl]thiophene-2-carboxamide
CID 30889612
3-[2-[(2-amino-2-thiophen-2-ylacetyl)amino]ethyl]benzoic acid
CID 115287296
2-amino-4-methyl-N-(2-pyridin-3-ylethyl)pentanamide
CID 60913916
1,1-dimethyl-3-(2-pyridin-3-ylethyl)urea
CID 110872248
2-amino-N-[(6-methyl-3-pyridinyl)methyl]-2-thiophen-2-ylacetamide
CID 115287220
2-amino-N-(2-methylpropyl)-2-thiophen-2-ylacetamide
CID 115285812
2-amino-N-[2-(4-methyl-1,2,4-triazol-3-yl)ethyl]-2-thiophen-2-ylacetamide
CID 115287271
N-ethyl-3-pyridin-3-yl-1-thiophen-2-ylpropan-1-amine
CID 105100649
1-propyl-3-(2-pyridin-3-ylethyl)urea
CID 115578203
2-amino-N-[(2R)-2-hydroxypropyl]-2-thiophen-2-ylacetamide
CID 107221006
2-amino-3-(2-pyridin-3-ylethylamino)propanoic acid
CID 64584041

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide?
The IUPAC name of 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide (CID 113279110) is 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide is NC(C(=O)NCCc1cccnc1)c1cccs1.
What is the InChIKey of 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide?
The InChIKey is IQAQWPWQKTVZLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3OS/c14-12(11-4-2-8-18-11)13(17)16-7-5-10-3-1-6-15-9-10/h1-4,6,8-9,12H,5,7,14H2,(H,16,17).
What are the key properties of 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide?
2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide has a molecular weight of 261.35 g/mol, XLogP of 1.50, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-pyridin-3-ylethyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 113279110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).