[2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone

C16H23NO2S — CID 45231421

IUPAC[2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)N1CCOC(CC2CCCCC2)C1
InChIInChI=1S/C16H23NO2S/c18-16(14-6-9-20-12-14)17-7-8-19-15(11-17)10-13-4-2-1-3-5-13/h6,9,12-13,15H,1-5,7-8,10-11H2
InChIKeyLTDRZTKCIDRWKD-UHFFFAOYSA-N
MW293.43 g/mol
LogP3.56
Rot. Bonds3

About [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone

[2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone (PubChem CID 45231421) has the molecular formula C16H23NO2S and a molecular weight of 293.43 g/mol. Its IUPAC name is [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone.

Molecular Properties

Compound Name[2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone
PubChem CID45231421
Molecular FormulaC16H23NO2S
Molecular Weight293.43 g/mol
Exact Mass293.14
IUPAC Name[2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone
SMILESO=C(c1ccsc1)N1CCOC(CC2CCCCC2)C1
InChIInChI=1S/C16H23NO2S/c18-16(14-6-9-20-12-14)17-7-8-19-15(11-17)10-13-4-2-1-3-5-13/h6,9,12-13,15H,1-5,7-8,10-11H2
InChIKeyLTDRZTKCIDRWKD-UHFFFAOYSA-N
XLogP3.56
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.43
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone 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-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone?
The IUPAC name of [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone (CID 45231421) is [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone.
What is the SMILES notation for [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone?
The canonical SMILES for [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone is O=C(c1ccsc1)N1CCOC(CC2CCCCC2)C1.
What is the InChIKey of [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone?
The InChIKey is LTDRZTKCIDRWKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2S/c18-16(14-6-9-20-12-14)17-7-8-19-15(11-17)10-13-4-2-1-3-5-13/h6,9,12-13,15H,1-5,7-8,10-11H2.
What are the key properties of [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone?
[2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone has a molecular weight of 293.43 g/mol, XLogP of 3.56, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(cyclohexylmethyl)morpholin-4-yl]-thiophen-3-ylmethanone is sourced from PubChem (CID 45231421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).