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

C13H17NOS — CID 71786834

IUPACcyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone
SMILESO=C(C1CC1)N1CCC(c2cccs2)CC1
InChIInChI=1S/C13H17NOS/c15-13(11-3-4-11)14-7-5-10(6-8-14)12-2-1-9-16-12/h1-2,9-11H,3-8H2
InChIKeyQPQLZXSFGHRQRJ-UHFFFAOYSA-N
MW235.35 g/mol
LogP2.86
Rot. Bonds2

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

cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone (PubChem CID 71786834) has the molecular formula C13H17NOS and a molecular weight of 235.35 g/mol. Its IUPAC name is cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone.

Molecular Properties

Compound Namecyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone
PubChem CID71786834
Molecular FormulaC13H17NOS
Molecular Weight235.35 g/mol
Exact Mass235.10
IUPAC Namecyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone
SMILESO=C(C1CC1)N1CCC(c2cccs2)CC1
InChIInChI=1S/C13H17NOS/c15-13(11-3-4-11)14-7-5-10(6-8-14)12-2-1-9-16-12/h1-2,9-11H,3-8H2
InChIKeyQPQLZXSFGHRQRJ-UHFFFAOYSA-N
XLogP2.86
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.35
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
The IUPAC name of cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone (CID 71786834) is cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone.
What is the SMILES notation for cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
The canonical SMILES for cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone is O=C(C1CC1)N1CCC(c2cccs2)CC1.
What is the InChIKey of cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
The InChIKey is QPQLZXSFGHRQRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NOS/c15-13(11-3-4-11)14-7-5-10(6-8-14)12-2-1-9-16-12/h1-2,9-11H,3-8H2.
What are the key properties of cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone?
cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone has a molecular weight of 235.35 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-(4-thiophen-2-ylpiperidin-1-yl)methanone is sourced from PubChem (CID 71786834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).