1-thiophen-3-ylcyclohexane-1-carboxamide

C11H15NOS — CID 3056605

IUPAC1-thiophen-3-ylcyclohexane-1-carboxamide
SMILESNC(=O)C1(c2ccsc2)CCCCC1
InChIInChI=1S/C11H15NOS/c12-10(13)11(5-2-1-3-6-11)9-4-7-14-8-9/h4,7-8H,1-3,5-6H2,(H2,12,13)
InChIKeyCWWXNBDSUXNCGB-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.44
Rot. Bonds2

About 1-thiophen-3-ylcyclohexane-1-carboxamide

1-thiophen-3-ylcyclohexane-1-carboxamide (PubChem CID 3056605) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is 1-thiophen-3-ylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-thiophen-3-ylcyclohexane-1-carboxamide
PubChem CID3056605
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC Name1-thiophen-3-ylcyclohexane-1-carboxamide
SMILESNC(=O)C1(c2ccsc2)CCCCC1
InChIInChI=1S/C11H15NOS/c12-10(13)11(5-2-1-3-6-11)9-4-7-14-8-9/h4,7-8H,1-3,5-6H2,(H2,12,13)
InChIKeyCWWXNBDSUXNCGB-UHFFFAOYSA-N
XLogP2.44
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-thiophen-3-ylcyclohexane-1-carboxamide?
The IUPAC name of 1-thiophen-3-ylcyclohexane-1-carboxamide (CID 3056605) is 1-thiophen-3-ylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-thiophen-3-ylcyclohexane-1-carboxamide?
The canonical SMILES for 1-thiophen-3-ylcyclohexane-1-carboxamide is NC(=O)C1(c2ccsc2)CCCCC1.
What is the InChIKey of 1-thiophen-3-ylcyclohexane-1-carboxamide?
The InChIKey is CWWXNBDSUXNCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c12-10(13)11(5-2-1-3-6-11)9-4-7-14-8-9/h4,7-8H,1-3,5-6H2,(H2,12,13).
What are the key properties of 1-thiophen-3-ylcyclohexane-1-carboxamide?
1-thiophen-3-ylcyclohexane-1-carboxamide has a molecular weight of 209.31 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-3-ylcyclohexane-1-carboxamide is sourced from PubChem (CID 3056605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).