N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide

C12H22N2O2S — CID 114627981

IUPACN-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide
SMILESO=C(CSC1CCNCC1)NOC1CCCC1
InChIInChI=1S/C12H22N2O2S/c15-12(14-16-10-3-1-2-4-10)9-17-11-5-7-13-8-6-11/h10-11,13H,1-9H2,(H,14,15)
InChIKeySKVINDTVJPEULX-UHFFFAOYSA-N
MW258.39 g/mol
LogP1.46
Rot. Bonds5

About N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide

N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide (PubChem CID 114627981) has the molecular formula C12H22N2O2S and a molecular weight of 258.39 g/mol. Its IUPAC name is N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide.

Molecular Properties

Compound NameN-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide
PubChem CID114627981
Molecular FormulaC12H22N2O2S
Molecular Weight258.39 g/mol
Exact Mass258.14
IUPAC NameN-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide
SMILESO=C(CSC1CCNCC1)NOC1CCCC1
InChIInChI=1S/C12H22N2O2S/c15-12(14-16-10-3-1-2-4-10)9-17-11-5-7-13-8-6-11/h10-11,13H,1-9H2,(H,14,15)
InChIKeySKVINDTVJPEULX-UHFFFAOYSA-N
XLogP1.46
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-hydroxy-2-piperidin-4-ylsulfanylacetamide
CID 114627599
N-cyclopentyloxy-2-(cyclopropylmethylamino)acetamide
CID 83235393
N-(dicyclopropylmethyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627232
methyl (2S)-3-methyl-2-[(2-piperidin-4-ylsulfanylacetyl)amino]butanoate
CID 104940371
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627230
N-(6-hydroxyhexyl)-2-piperidin-4-ylsulfanylacetamide
CID 107842483
2-piperidin-4-ylsulfanyl-N-[2-(trifluoromethyl)cyclohexyl]acetamide
CID 114626833
methyl 4-methyl-2-[(2-piperidin-4-ylsulfanylacetyl)amino]pentanoate
CID 114626748
N-(1-hydroxypropan-2-yl)-2-piperidin-4-ylsulfanylacetamide
CID 114626594
N-[(2S)-1-hydroxypropan-2-yl]-2-piperidin-4-ylsulfanylacetamide
CID 107219108
N-tert-butyl-2-[(2-piperidin-4-ylsulfanylacetyl)amino]acetamide
CID 114626598
5-[(2-piperidin-4-ylsulfanylacetyl)amino]pentanamide
CID 106235677

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide?
The IUPAC name of N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide (CID 114627981) is N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide.
What is the SMILES notation for N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide?
The canonical SMILES for N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide is O=C(CSC1CCNCC1)NOC1CCCC1.
What is the InChIKey of N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide?
The InChIKey is SKVINDTVJPEULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2S/c15-12(14-16-10-3-1-2-4-10)9-17-11-5-7-13-8-6-11/h10-11,13H,1-9H2,(H,14,15).
What are the key properties of N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide?
N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide has a molecular weight of 258.39 g/mol, XLogP of 1.46, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-2-piperidin-4-ylsulfanylacetamide is sourced from PubChem (CID 114627981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).