2-amino-N-thiophen-2-ylpentanamide

C9H14N2OS — CID 83618453

IUPAC2-amino-N-thiophen-2-ylpentanamide
SMILESCCCC(N)C(=O)Nc1cccs1
InChIInChI=1S/C9H14N2OS/c1-2-4-7(10)9(12)11-8-5-3-6-13-8/h3,5-7H,2,4,10H2,1H3,(H,11,12)
InChIKeyDRDQKIPIKJLOOV-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.81
Rot. Bonds4

About 2-amino-N-thiophen-2-ylpentanamide

2-amino-N-thiophen-2-ylpentanamide (PubChem CID 83618453) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 2-amino-N-thiophen-2-ylpentanamide.

Molecular Properties

Compound Name2-amino-N-thiophen-2-ylpentanamide
PubChem CID83618453
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name2-amino-N-thiophen-2-ylpentanamide
SMILESCCCC(N)C(=O)Nc1cccs1
InChIInChI=1S/C9H14N2OS/c1-2-4-7(10)9(12)11-8-5-3-6-13-8/h3,5-7H,2,4,10H2,1H3,(H,11,12)
InChIKeyDRDQKIPIKJLOOV-UHFFFAOYSA-N
XLogP1.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-thiophen-2-ylpentanamide?
The IUPAC name of 2-amino-N-thiophen-2-ylpentanamide (CID 83618453) is 2-amino-N-thiophen-2-ylpentanamide.
What is the SMILES notation for 2-amino-N-thiophen-2-ylpentanamide?
The canonical SMILES for 2-amino-N-thiophen-2-ylpentanamide is CCCC(N)C(=O)Nc1cccs1.
What is the InChIKey of 2-amino-N-thiophen-2-ylpentanamide?
The InChIKey is DRDQKIPIKJLOOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-2-4-7(10)9(12)11-8-5-3-6-13-8/h3,5-7H,2,4,10H2,1H3,(H,11,12).
What are the key properties of 2-amino-N-thiophen-2-ylpentanamide?
2-amino-N-thiophen-2-ylpentanamide has a molecular weight of 198.29 g/mol, XLogP of 1.81, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-thiophen-2-ylpentanamide is sourced from PubChem (CID 83618453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).