1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine

C15H26N2S — CID 81344411

IUPAC1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine
SMILESCC1CC(NCC(C)(C)c2cccs2)CCN1C
InChIInChI=1S/C15H26N2S/c1-12-10-13(7-8-17(12)4)16-11-15(2,3)14-6-5-9-18-14/h5-6,9,12-13,16H,7-8,10-11H2,1-4H3
InChIKeyRJYCANXSTSHNOS-UHFFFAOYSA-N
MW266.45 g/mol
LogP3.10
Rot. Bonds4

About 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine

1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine (PubChem CID 81344411) has the molecular formula C15H26N2S and a molecular weight of 266.45 g/mol. Its IUPAC name is 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine.

Molecular Properties

Compound Name1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine
PubChem CID81344411
Molecular FormulaC15H26N2S
Molecular Weight266.45 g/mol
Exact Mass266.18
IUPAC Name1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine
SMILESCC1CC(NCC(C)(C)c2cccs2)CCN1C
InChIInChI=1S/C15H26N2S/c1-12-10-13(7-8-17(12)4)16-11-15(2,3)14-6-5-9-18-14/h5-6,9,12-13,16H,7-8,10-11H2,1-4H3
InChIKeyRJYCANXSTSHNOS-UHFFFAOYSA-N
XLogP3.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.45
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine?
The IUPAC name of 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine (CID 81344411) is 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine.
What is the SMILES notation for 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine?
The canonical SMILES for 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine is CC1CC(NCC(C)(C)c2cccs2)CCN1C.
What is the InChIKey of 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine?
The InChIKey is RJYCANXSTSHNOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2S/c1-12-10-13(7-8-17(12)4)16-11-15(2,3)14-6-5-9-18-14/h5-6,9,12-13,16H,7-8,10-11H2,1-4H3.
What are the key properties of 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine?
1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine has a molecular weight of 266.45 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)piperidin-4-amine is sourced from PubChem (CID 81344411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).