N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine

C13H22N2S — CID 62842076

IUPACN,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine
SMILESCNC1CCN(C(C)c2ccsc2)CC1C
InChIInChI=1S/C13H22N2S/c1-10-8-15(6-4-13(10)14-3)11(2)12-5-7-16-9-12/h5,7,9-11,13-14H,4,6,8H2,1-3H3
InChIKeyDJKPUDPTGINJPQ-UHFFFAOYSA-N
MW238.40 g/mol
LogP2.74
Rot. Bonds3

About N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine

N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine (PubChem CID 62842076) has the molecular formula C13H22N2S and a molecular weight of 238.40 g/mol. Its IUPAC name is N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine.

Molecular Properties

Compound NameN,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine
PubChem CID62842076
Molecular FormulaC13H22N2S
Molecular Weight238.40 g/mol
Exact Mass238.15
IUPAC NameN,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine
SMILESCNC1CCN(C(C)c2ccsc2)CC1C
InChIInChI=1S/C13H22N2S/c1-10-8-15(6-4-13(10)14-3)11(2)12-5-7-16-9-12/h5,7,9-11,13-14H,4,6,8H2,1-3H3
InChIKeyDJKPUDPTGINJPQ-UHFFFAOYSA-N
XLogP2.74
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.40
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-thiophen-3-ylethyl)piperidin-4-amine
CID 62089674
N,3-dimethyl-1-(1-thiophen-2-ylpropan-2-yl)piperidin-4-amine
CID 55171951
[1-(1-thiophen-3-ylethyl)piperidin-4-yl]methanamine
CID 62090353
N-propyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine
CID 55126416
N,3-dimethyl-1-(1-thiophen-2-ylpropyl)piperidin-4-amine
CID 54976100
N,3-dimethyl-1-(1-phenylpropyl)piperidin-4-amine
CID 62304545
1-[(1S)-1-thiophen-3-ylethyl]piperazine;dihydrochloride
CID 171280726
1-(1-thiophen-3-ylethyl)-4-(triazol-1-yl)piperidine
CID 121183694
1-[1-(furan-2-yl)propan-2-yl]-N,3-dimethylpiperidin-4-amine
CID 54975952
3-butan-2-yl-1-(1-thiophen-3-ylethyl)-1,4-diazepane
CID 64950770
N,3-dimethyl-1-propan-2-ylazepan-4-amine
CID 142347784
N-(1-thiophen-3-ylethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-amine
CID 62090694

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine?
The IUPAC name of N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine (CID 62842076) is N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine.
What is the SMILES notation for N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine?
The canonical SMILES for N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine is CNC1CCN(C(C)c2ccsc2)CC1C.
What is the InChIKey of N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine?
The InChIKey is DJKPUDPTGINJPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2S/c1-10-8-15(6-4-13(10)14-3)11(2)12-5-7-16-9-12/h5,7,9-11,13-14H,4,6,8H2,1-3H3.
What are the key properties of N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine?
N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine has a molecular weight of 238.40 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-1-(1-thiophen-3-ylethyl)piperidin-4-amine is sourced from PubChem (CID 62842076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).