N-(2-methyl-1-thiophen-2-ylpropyl)propanamide

C11H17NOS — CID 60666432

IUPACN-(2-methyl-1-thiophen-2-ylpropyl)propanamide
SMILESCCC(=O)NC(c1cccs1)C(C)C
InChIInChI=1S/C11H17NOS/c1-4-10(13)12-11(8(2)3)9-6-5-7-14-9/h5-8,11H,4H2,1-3H3,(H,12,13)
InChIKeyPTEOJJAHRKGJDA-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.97
Rot. Bonds4

About N-(2-methyl-1-thiophen-2-ylpropyl)propanamide

N-(2-methyl-1-thiophen-2-ylpropyl)propanamide (PubChem CID 60666432) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is N-(2-methyl-1-thiophen-2-ylpropyl)propanamide.

Molecular Properties

Compound NameN-(2-methyl-1-thiophen-2-ylpropyl)propanamide
PubChem CID60666432
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC NameN-(2-methyl-1-thiophen-2-ylpropyl)propanamide
SMILESCCC(=O)NC(c1cccs1)C(C)C
InChIInChI=1S/C11H17NOS/c1-4-10(13)12-11(8(2)3)9-6-5-7-14-9/h5-8,11H,4H2,1-3H3,(H,12,13)
InChIKeyPTEOJJAHRKGJDA-UHFFFAOYSA-N
XLogP2.97
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1-thiophen-2-ylpropyl)propanamide?
The IUPAC name of N-(2-methyl-1-thiophen-2-ylpropyl)propanamide (CID 60666432) is N-(2-methyl-1-thiophen-2-ylpropyl)propanamide.
What is the SMILES notation for N-(2-methyl-1-thiophen-2-ylpropyl)propanamide?
The canonical SMILES for N-(2-methyl-1-thiophen-2-ylpropyl)propanamide is CCC(=O)NC(c1cccs1)C(C)C.
What is the InChIKey of N-(2-methyl-1-thiophen-2-ylpropyl)propanamide?
The InChIKey is PTEOJJAHRKGJDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-4-10(13)12-11(8(2)3)9-6-5-7-14-9/h5-8,11H,4H2,1-3H3,(H,12,13).
What are the key properties of N-(2-methyl-1-thiophen-2-ylpropyl)propanamide?
N-(2-methyl-1-thiophen-2-ylpropyl)propanamide has a molecular weight of 211.33 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1-thiophen-2-ylpropyl)propanamide is sourced from PubChem (CID 60666432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).