N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide

C13H19NOS — CID 2474427

IUPACN-(cyclohexylmethyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCC1CCCCC1
InChIInChI=1S/C13H19NOS/c15-13(9-12-7-4-8-16-12)14-10-11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10H2,(H,14,15)
InChIKeyOKTOQKZXAMHOHQ-UHFFFAOYSA-N
MW237.37 g/mol
LogP2.99
Rot. Bonds4

About N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide

N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide (PubChem CID 2474427) has the molecular formula C13H19NOS and a molecular weight of 237.37 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-thiophen-2-ylacetamide
PubChem CID2474427
Molecular FormulaC13H19NOS
Molecular Weight237.37 g/mol
Exact Mass237.12
IUPAC NameN-(cyclohexylmethyl)-2-thiophen-2-ylacetamide
SMILESO=C(Cc1cccs1)NCC1CCCCC1
InChIInChI=1S/C13H19NOS/c15-13(9-12-7-4-8-16-12)14-10-11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10H2,(H,14,15)
InChIKeyOKTOQKZXAMHOHQ-UHFFFAOYSA-N
XLogP2.99
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.37
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide (CID 2474427) is N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide is O=C(Cc1cccs1)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide?
The InChIKey is OKTOQKZXAMHOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NOS/c15-13(9-12-7-4-8-16-12)14-10-11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10H2,(H,14,15).
What are the key properties of N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide?
N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide has a molecular weight of 237.37 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 2474427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).