oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone

C14H18N2O3S — CID 2970763

IUPACoxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone
SMILESO=C(c1cccs1)N1CCN(C(=O)C2CCCO2)CC1
InChIInChI=1S/C14H18N2O3S/c17-13(11-3-1-9-19-11)15-5-7-16(8-6-15)14(18)12-4-2-10-20-12/h2,4,10-11H,1,3,5-9H2
InChIKeyHHVUVBZOZXNSCX-UHFFFAOYSA-N
MW294.38 g/mol
LogP1.21
Rot. Bonds2

About oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone

oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone (PubChem CID 2970763) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone.

Molecular Properties

Compound Nameoxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone
PubChem CID2970763
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Nameoxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone
SMILESO=C(c1cccs1)N1CCN(C(=O)C2CCCO2)CC1
InChIInChI=1S/C14H18N2O3S/c17-13(11-3-1-9-19-11)15-5-7-16(8-6-15)14(18)12-4-2-10-20-12/h2,4,10-11H,1,3,5-9H2
InChIKeyHHVUVBZOZXNSCX-UHFFFAOYSA-N
XLogP1.21
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Thiophene-2-carboxamide, N-tetrahydrofurfuryl-
CID 531922
Thiophene-2-carboxylic acid, morpholide
CID 531921
2,6-Dimethylmorpholin-4-yl 2-thienyl ketone
CID 2851287
1-(Tetrahydro-2-furanylcarbonyl)-4-(2-thienylacetyl)piperazine
CID 2971550
Morpholin-4-yl-[4-(thiophene-2-carbonyl)-piperazin-1-yl]-methanone
CID 650494
1-(4,5,6,7-Tetrahydro-1-benzothien-2-ylcarbonyl)-4-(tetrahydro-2-furanylcarbonyl)piperazine
CID 2970927
N-[2-(morpholin-4-yl)ethyl]thiophene-2-carboxamide
CID 652318
[(4aR,7aS)-4-(2-methoxyethyl)-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazin-6-yl]-thiophen-2-ylmethanone
CID 97508947
[(4aS,9aS)-4-[2-(dimethylamino)ethyl]-2,3,4a,5,6,8,9,9a-octahydro-[1,4]oxazino[2,3-d]azepin-7-yl]-thiophen-2-ylmethanone
CID 97511064
[(5aR,9aS)-4-[2-(dimethylamino)ethyl]-2,3,5,5a,6,7,9,9a-octahydropyrido[4,3-f][1,4]oxazepin-8-yl]-thiophen-2-ylmethanone
CID 97511342
[(2S,4S)-4-fluoro-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]-morpholin-4-ylmethanone
CID 110876012
[(4aR,7aS)-4-(oxolan-2-ylmethyl)-2,3,4a,5,7,7a-hexahydropyrrolo[3,4-b][1,4]oxazin-6-yl]-thiophen-2-ylmethanone
CID 127021137

Frequently Asked Questions

What is the IUPAC name of oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone?
The IUPAC name of oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone (CID 2970763) is oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone.
What is the SMILES notation for oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone?
The canonical SMILES for oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone is O=C(c1cccs1)N1CCN(C(=O)C2CCCO2)CC1.
What is the InChIKey of oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone?
The InChIKey is HHVUVBZOZXNSCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c17-13(11-3-1-9-19-11)15-5-7-16(8-6-15)14(18)12-4-2-10-20-12/h2,4,10-11H,1,3,5-9H2.
What are the key properties of oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone?
oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone has a molecular weight of 294.38 g/mol, XLogP of 1.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-yl-[4-(thiophene-2-carbonyl)piperazin-1-yl]methanone is sourced from PubChem (CID 2970763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).