N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride

C12H21ClN2S — CID 71642773

IUPACN-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride
SMILESCNC1CCN(C(C)c2cccs2)CC1.Cl
InChIInChI=1S/C12H20N2S.ClH/c1-10(12-4-3-9-15-12)14-7-5-11(13-2)6-8-14;/h3-4,9-11,13H,5-8H2,1-2H3;1H
InChIKeyVTJRIRDKXLDKIF-UHFFFAOYSA-N
MW260.83 g/mol
LogP2.91
Rot. Bonds3

About N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride

N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride (PubChem CID 71642773) has the molecular formula C12H21ClN2S and a molecular weight of 260.83 g/mol. Its IUPAC name is N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride.

Molecular Properties

Compound NameN-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride
PubChem CID71642773
Molecular FormulaC12H21ClN2S
Molecular Weight260.83 g/mol
Exact Mass260.11
IUPAC NameN-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride
SMILESCNC1CCN(C(C)c2cccs2)CC1.Cl
InChIInChI=1S/C12H20N2S.ClH/c1-10(12-4-3-9-15-12)14-7-5-11(13-2)6-8-14;/h3-4,9-11,13H,5-8H2,1-2H3;1H
InChIKeyVTJRIRDKXLDKIF-UHFFFAOYSA-N
XLogP2.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.83
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(1S)-1-thiophen-2-ylethyl]piperidin-4-yl]methanol
CID 97175553
(3S)-1-[(1S)-1-thiophen-2-ylethyl]pyrrolidin-3-amine
CID 93316384
1-propan-2-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43182947
1,3,5-tris(1-thiophen-2-ylethyl)-1,3,5-triazinane
CID 68714918
1-propan-2-yl-N-(2-thiophen-2-ylpropyl)piperidin-4-amine
CID 75428213
1-[1-(3-chlorophenyl)ethyl]-N-methylpiperidin-4-amine;hydrochloride
CID 119923709
1-pyridin-4-yl-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 43343794
N-[cyclopentyl(thiophen-2-yl)methyl]-1-propan-2-ylpiperidin-4-amine
CID 43740557
1-[1-(3-chlorophenyl)ethyl]-N-methylpiperidin-4-amine
CID 54965150
1-(2-methylpropyl)-N-(1-thiophen-2-ylethyl)piperidin-4-amine
CID 103775855
[(3R)-1-[(1S)-1-thiophen-2-ylethyl]piperidin-3-yl]methanol
CID 98084280
N,N-dimethyl-4-[[(1R)-1-thiophen-2-ylethyl]amino]piperidine-1-carboxamide
CID 83261830

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride?
The IUPAC name of N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride (CID 71642773) is N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride.
What is the SMILES notation for N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride?
The canonical SMILES for N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride is CNC1CCN(C(C)c2cccs2)CC1.Cl.
What is the InChIKey of N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride?
The InChIKey is VTJRIRDKXLDKIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2S.ClH/c1-10(12-4-3-9-15-12)14-7-5-11(13-2)6-8-14;/h3-4,9-11,13H,5-8H2,1-2H3;1H.
What are the key properties of N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride?
N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride has a molecular weight of 260.83 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-thiophen-2-ylethyl)piperidin-4-amine;hydrochloride is sourced from PubChem (CID 71642773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).