5-thiophen-3-ylpentanamide

C9H13NOS — CID 11171370

IUPAC5-thiophen-3-ylpentanamide
SMILESNC(=O)CCCCc1ccsc1
InChIInChI=1S/C9H13NOS/c10-9(11)4-2-1-3-8-5-6-12-7-8/h5-7H,1-4H2,(H2,10,11)
InChIKeyOWEGPFZXPYDRJR-UHFFFAOYSA-N
MW183.28 g/mol
LogP1.95
Rot. Bonds5

About 5-thiophen-3-ylpentanamide

5-thiophen-3-ylpentanamide (PubChem CID 11171370) has the molecular formula C9H13NOS and a molecular weight of 183.28 g/mol. Its IUPAC name is 5-thiophen-3-ylpentanamide.

Molecular Properties

Compound Name5-thiophen-3-ylpentanamide
PubChem CID11171370
Molecular FormulaC9H13NOS
Molecular Weight183.28 g/mol
Exact Mass183.07
IUPAC Name5-thiophen-3-ylpentanamide
SMILESNC(=O)CCCCc1ccsc1
InChIInChI=1S/C9H13NOS/c10-9(11)4-2-1-3-8-5-6-12-7-8/h5-7H,1-4H2,(H2,10,11)
InChIKeyOWEGPFZXPYDRJR-UHFFFAOYSA-N
XLogP1.95
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.28
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-thiophen-3-ylhexanoic acid
CID 24722734
1-phenyl-5-thiophen-3-ylpentan-1-one
CID 64503847
4-thiophen-3-ylbutanoate
CID 86324435
4-thiophen-3-ylbutan-1-ol
CID 54222621
18-[4-(18-amino-18-oxooctadecyl)phenyl]octadecanamide
CID 66765992
1-pyrrolidin-1-yl-7-thiophen-3-ylheptan-1-one
CID 155562244
12-thiophen-3-yldodecan-1-ol
CID 67533520
5-thiophen-3-ylpentanal
CID 15807672
8-thiophen-3-yloctane-1-sulfonic acid
CID 87451833
4-thiophen-3-ylbutoxysulfonylmethyl 4-thiophen-3-ylbutanoate
CID 88649309
3-heptylthiophene;3-hexylthiophene
CID 159152668
3-(6-bromohexyl)thiophene
CID 11447992

Frequently Asked Questions

What is the IUPAC name of 5-thiophen-3-ylpentanamide?
The IUPAC name of 5-thiophen-3-ylpentanamide (CID 11171370) is 5-thiophen-3-ylpentanamide.
What is the SMILES notation for 5-thiophen-3-ylpentanamide?
The canonical SMILES for 5-thiophen-3-ylpentanamide is NC(=O)CCCCc1ccsc1.
What is the InChIKey of 5-thiophen-3-ylpentanamide?
The InChIKey is OWEGPFZXPYDRJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NOS/c10-9(11)4-2-1-3-8-5-6-12-7-8/h5-7H,1-4H2,(H2,10,11).
What are the key properties of 5-thiophen-3-ylpentanamide?
5-thiophen-3-ylpentanamide has a molecular weight of 183.28 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-3-ylpentanamide is sourced from PubChem (CID 11171370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).