thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone

C14H15NOS2 — CID 71786843

IUPACthiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone
SMILESO=C(c1ccsc1)N1CCC(c2cccs2)CC1
InChIInChI=1S/C14H15NOS2/c16-14(12-5-9-17-10-12)15-6-3-11(4-7-15)13-2-1-8-18-13/h1-2,5,8-11H,3-4,6-7H2
InChIKeyUMNKDWQQSVHFIP-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.83
Rot. Bonds2

About thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone

thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone (PubChem CID 71786843) has the molecular formula C14H15NOS2 and a molecular weight of 277.41 g/mol. Its IUPAC name is thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Namethiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone
PubChem CID71786843
Molecular FormulaC14H15NOS2
Molecular Weight277.41 g/mol
Exact Mass277.06
IUPAC Namethiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone
SMILESO=C(c1ccsc1)N1CCC(c2cccs2)CC1
InChIInChI=1S/C14H15NOS2/c16-14(12-5-9-17-10-12)15-6-3-11(4-7-15)13-2-1-8-18-13/h1-2,5,8-11H,3-4,6-7H2
InChIKeyUMNKDWQQSVHFIP-UHFFFAOYSA-N
XLogP3.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(4-thiophen-2-ylpiperidin-1-yl)-(3,4,5-trimethoxyphenyl)methanone
CID 90522152
3-thiophen-3-yl-1-(4-thiophen-2-ylpiperidin-1-yl)prop-2-en-1-one
CID 71960797
(2-methylphenyl)-(4-thiophen-2-ylpiperidin-1-yl)methanone
CID 71786844
[4-(5-methyl-1,3,4-thiadiazol-2-yl)piperidin-1-yl]-thiophen-3-ylmethanone
CID 71780427
[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-thiophen-3-ylmethanone
CID 27782572
2-chloro-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone
CID 82130314
2-amino-1-(4-thiophen-2-ylpiperidin-1-yl)ethanone
CID 82128116
[4-(3-cyclopropyl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]-thiophen-3-ylmethanone
CID 53192432
4-oxo-4-(4-thiophen-2-ylpiperidin-1-yl)butanoic acid
CID 82134002
[7-(2-fluorophenyl)-1,4-thiazepan-4-yl]-thiophen-3-ylmethanone
CID 90630207
(4-piperidin-1-ylsulfonylpiperidin-1-yl)-thiophen-3-ylmethanone
CID 138024622
1-[4-(thiophene-3-carbonyl)-1,4-diazepan-1-yl]-2-thiophen-2-ylethanone
CID 137337229

Frequently Asked Questions

What is the IUPAC name of thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
The IUPAC name of thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone (CID 71786843) is thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone.
What is the SMILES notation for thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
The canonical SMILES for thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone is O=C(c1ccsc1)N1CCC(c2cccs2)CC1.
What is the InChIKey of thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
The InChIKey is UMNKDWQQSVHFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS2/c16-14(12-5-9-17-10-12)15-6-3-11(4-7-15)13-2-1-8-18-13/h1-2,5,8-11H,3-4,6-7H2.
What are the key properties of thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone has a molecular weight of 277.41 g/mol, XLogP of 3.83, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thiophen-3-yl-(4-thiophen-2-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 71786843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).