1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine

C14H24N2S — CID 107555653

IUPAC1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine
SMILESCNCc1ccc(CN2CC(C)CC(C)C2)s1
InChIInChI=1S/C14H24N2S/c1-11-6-12(2)9-16(8-11)10-14-5-4-13(17-14)7-15-3/h4-5,11-12,15H,6-10H2,1-3H3
InChIKeyFBCSVYSHMOCTOK-UHFFFAOYSA-N
MW252.43 g/mol
LogP2.95
Rot. Bonds4

About 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine

1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine (PubChem CID 107555653) has the molecular formula C14H24N2S and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine
PubChem CID107555653
Molecular FormulaC14H24N2S
Molecular Weight252.43 g/mol
Exact Mass252.17
IUPAC Name1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine
SMILESCNCc1ccc(CN2CC(C)CC(C)C2)s1
InChIInChI=1S/C14H24N2S/c1-11-6-12(2)9-16(8-11)10-14-5-4-13(17-14)7-15-3/h4-5,11-12,15H,6-10H2,1-3H3
InChIKeyFBCSVYSHMOCTOK-UHFFFAOYSA-N
XLogP2.95
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine?
The IUPAC name of 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine (CID 107555653) is 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine?
The canonical SMILES for 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine is CNCc1ccc(CN2CC(C)CC(C)C2)s1.
What is the InChIKey of 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine?
The InChIKey is FBCSVYSHMOCTOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2S/c1-11-6-12(2)9-16(8-11)10-14-5-4-13(17-14)7-15-3/h4-5,11-12,15H,6-10H2,1-3H3.
What are the key properties of 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine?
1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine has a molecular weight of 252.43 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-[(3,5-dimethylpiperidin-1-yl)methyl]thiophen-2-yl]-N-methylmethanamine is sourced from PubChem (CID 107555653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).