(2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide

C10H14N2OS — CID 14599707

IUPAC(2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide
SMILESC[C@@H](N)C(=O)NC/C=C/c1ccsc1
InChIInChI=1S/C10H14N2OS/c1-8(11)10(13)12-5-2-3-9-4-6-14-7-9/h2-4,6-8H,5,11H2,1H3,(H,12,13)/b3-2+/t8-/m1/s1
InChIKeyMNHMVROPBJCLCH-UFUPEUMYSA-N
MW210.30 g/mol
LogP1.22
Rot. Bonds4

About (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide

(2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide (PubChem CID 14599707) has the molecular formula C10H14N2OS and a molecular weight of 210.30 g/mol. Its IUPAC name is (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide
PubChem CID14599707
Molecular FormulaC10H14N2OS
Molecular Weight210.30 g/mol
Exact Mass210.08
IUPAC Name(2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide
SMILESC[C@@H](N)C(=O)NC/C=C/c1ccsc1
InChIInChI=1S/C10H14N2OS/c1-8(11)10(13)12-5-2-3-9-4-6-14-7-9/h2-4,6-8H,5,11H2,1H3,(H,12,13)/b3-2+/t8-/m1/s1
InChIKeyMNHMVROPBJCLCH-UFUPEUMYSA-N
XLogP1.22
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.30
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide (CID 14599707) is (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide is C[C@@H](N)C(=O)NC/C=C/c1ccsc1.
What is the InChIKey of (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide?
The InChIKey is MNHMVROPBJCLCH-UFUPEUMYSA-N. The full InChI is InChI=1S/C10H14N2OS/c1-8(11)10(13)12-5-2-3-9-4-6-14-7-9/h2-4,6-8H,5,11H2,1H3,(H,12,13)/b3-2+/t8-/m1/s1.
What are the key properties of (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide?
(2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide has a molecular weight of 210.30 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[(E)-3-thiophen-3-ylprop-2-enyl]propanamide is sourced from PubChem (CID 14599707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).