2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide

C14H21NO3S — CID 99876331

IUPAC2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide
SMILESCO[C@@H](CNC(=O)CSC1CCCC1)c1ccco1
InChIInChI=1S/C14H21NO3S/c1-17-13(12-7-4-8-18-12)9-15-14(16)10-19-11-5-2-3-6-11/h4,7-8,11,13H,2-3,5-6,9-10H2,1H3,(H,15,16)/t13-/m0/s1
InChIKeyZJBOIVLARCDRON-ZDUSSCGKSA-N
MW283.39 g/mol
LogP2.76
Rot. Bonds7

About 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide

2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide (PubChem CID 99876331) has the molecular formula C14H21NO3S and a molecular weight of 283.39 g/mol. Its IUPAC name is 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide.

Molecular Properties

Compound Name2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide
PubChem CID99876331
Molecular FormulaC14H21NO3S
Molecular Weight283.39 g/mol
Exact Mass283.12
IUPAC Name2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide
SMILESCO[C@@H](CNC(=O)CSC1CCCC1)c1ccco1
InChIInChI=1S/C14H21NO3S/c1-17-13(12-7-4-8-18-12)9-15-14(16)10-19-11-5-2-3-6-11/h4,7-8,11,13H,2-3,5-6,9-10H2,1H3,(H,15,16)/t13-/m0/s1
InChIKeyZJBOIVLARCDRON-ZDUSSCGKSA-N
XLogP2.76
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.39
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
The IUPAC name of 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide (CID 99876331) is 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide.
What is the SMILES notation for 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
The canonical SMILES for 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide is CO[C@@H](CNC(=O)CSC1CCCC1)c1ccco1.
What is the InChIKey of 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
The InChIKey is ZJBOIVLARCDRON-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H21NO3S/c1-17-13(12-7-4-8-18-12)9-15-14(16)10-19-11-5-2-3-6-11/h4,7-8,11,13H,2-3,5-6,9-10H2,1H3,(H,15,16)/t13-/m0/s1.
What are the key properties of 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide?
2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide has a molecular weight of 283.39 g/mol, XLogP of 2.76, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentylsulfanyl-N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]acetamide is sourced from PubChem (CID 99876331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).