N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide

C17H26N2O2S — CID 32616444

IUPACN-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide
SMILESO=C(Cc1ccsc1)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C17H26N2O2S/c20-16(12-15-4-11-22-13-15)18-14-17(5-2-1-3-6-17)19-7-9-21-10-8-19/h4,11,13H,1-3,5-10,12,14H2,(H,18,20)
InChIKeySWDGZOKUVORUID-UHFFFAOYSA-N
MW322.47 g/mol
LogP2.44
Rot. Bonds5

About N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide

N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide (PubChem CID 32616444) has the molecular formula C17H26N2O2S and a molecular weight of 322.47 g/mol. Its IUPAC name is N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide
PubChem CID32616444
Molecular FormulaC17H26N2O2S
Molecular Weight322.47 g/mol
Exact Mass322.17
IUPAC NameN-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide
SMILESO=C(Cc1ccsc1)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C17H26N2O2S/c20-16(12-15-4-11-22-13-15)18-14-17(5-2-1-3-6-17)19-7-9-21-10-8-19/h4,11,13H,1-3,5-10,12,14H2,(H,18,20)
InChIKeySWDGZOKUVORUID-UHFFFAOYSA-N
XLogP2.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.47
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide?
The IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide (CID 32616444) is N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide?
The canonical SMILES for N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide is O=C(Cc1ccsc1)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide?
The InChIKey is SWDGZOKUVORUID-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2S/c20-16(12-15-4-11-22-13-15)18-14-17(5-2-1-3-6-17)19-7-9-21-10-8-19/h4,11,13H,1-3,5-10,12,14H2,(H,18,20).
What are the key properties of N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide?
N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide has a molecular weight of 322.47 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-morpholin-4-ylcyclohexyl)methyl]-2-thiophen-3-ylacetamide is sourced from PubChem (CID 32616444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).