N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide

C12H18N2OS — CID 142634213

IUPACN-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(Cc2ccsc2)CC1
InChIInChI=1S/C12H18N2OS/c1-10(15)13-12-2-5-14(6-3-12)8-11-4-7-16-9-11/h4,7,9,12H,2-3,5-6,8H2,1H3,(H,13,15)
InChIKeyQZWXCCSNEYNQRM-UHFFFAOYSA-N
MW238.36 g/mol
LogP1.85
Rot. Bonds3

About N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide

N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide (PubChem CID 142634213) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide
PubChem CID142634213
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC NameN-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide
SMILESCC(=O)NC1CCN(Cc2ccsc2)CC1
InChIInChI=1S/C12H18N2OS/c1-10(15)13-12-2-5-14(6-3-12)8-11-4-7-16-9-11/h4,7,9,12H,2-3,5-6,8H2,1H3,(H,13,15)
InChIKeyQZWXCCSNEYNQRM-UHFFFAOYSA-N
XLogP1.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide?
The IUPAC name of N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide (CID 142634213) is N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide is CC(=O)NC1CCN(Cc2ccsc2)CC1.
What is the InChIKey of N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide?
The InChIKey is QZWXCCSNEYNQRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c1-10(15)13-12-2-5-14(6-3-12)8-11-4-7-16-9-11/h4,7,9,12H,2-3,5-6,8H2,1H3,(H,13,15).
What are the key properties of N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide?
N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide has a molecular weight of 238.36 g/mol, XLogP of 1.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(thiophen-3-ylmethyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 142634213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).