[1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine

C11H18N2S — CID 23004745

IUPAC[1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine
SMILESNCC1CCN(Cc2cccs2)CC1
InChIInChI=1S/C11H18N2S/c12-8-10-3-5-13(6-4-10)9-11-2-1-7-14-11/h1-2,7,10H,3-6,8-9,12H2
InChIKeyKZGFXYFQDXOLOP-UHFFFAOYSA-N
MW210.35 g/mol
LogP1.92
Rot. Bonds3

About [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine

[1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine (PubChem CID 23004745) has the molecular formula C11H18N2S and a molecular weight of 210.35 g/mol. Its IUPAC name is [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine
PubChem CID23004745
Molecular FormulaC11H18N2S
Molecular Weight210.35 g/mol
Exact Mass210.12
IUPAC Name[1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine
SMILESNCC1CCN(Cc2cccs2)CC1
InChIInChI=1S/C11H18N2S/c12-8-10-3-5-13(6-4-10)9-11-2-1-7-14-11/h1-2,7,10H,3-6,8-9,12H2
InChIKeyKZGFXYFQDXOLOP-UHFFFAOYSA-N
XLogP1.92
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.35
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine?
The IUPAC name of [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine (CID 23004745) is [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine.
What is the SMILES notation for [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine?
The canonical SMILES for [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine is NCC1CCN(Cc2cccs2)CC1.
What is the InChIKey of [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine?
The InChIKey is KZGFXYFQDXOLOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2S/c12-8-10-3-5-13(6-4-10)9-11-2-1-7-14-11/h1-2,7,10H,3-6,8-9,12H2.
What are the key properties of [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine?
[1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine has a molecular weight of 210.35 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine is sourced from PubChem (CID 23004745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).