2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine

C14H25N3S — CID 66387783

IUPAC2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine
SMILESCC(CNCc1sccc1N)CN1CCCCC1
InChIInChI=1S/C14H25N3S/c1-12(11-17-6-3-2-4-7-17)9-16-10-14-13(15)5-8-18-14/h5,8,12,16H,2-4,6-7,9-11,15H2,1H3
InChIKeyXASFZNGTHDFVPO-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.54
Rot. Bonds6

About 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine

2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine (PubChem CID 66387783) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine.

Molecular Properties

Compound Name2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine
PubChem CID66387783
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine
SMILESCC(CNCc1sccc1N)CN1CCCCC1
InChIInChI=1S/C14H25N3S/c1-12(11-17-6-3-2-4-7-17)9-16-10-14-13(15)5-8-18-14/h5,8,12,16H,2-4,6-7,9-11,15H2,1H3
InChIKeyXASFZNGTHDFVPO-UHFFFAOYSA-N
XLogP2.54
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine with MolForge

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Related Compounds

1-N-[(3-aminothiophen-2-yl)methyl]-2-N,2-N-dimethylpropane-1,2-diamine
CID 66384977
2-methyl-N-[(5-methylfuran-2-yl)methyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 60957579
2-methyl-N-[(2-methylphenyl)methyl]-3-piperidin-1-ylpropan-1-amine
CID 54893415
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 115331632
N-[(4-chlorothiophen-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 79427153
N-[(5-iodofuran-2-yl)methyl]-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 62992693
2-methyl-N-[(5-nitrothiophen-3-yl)methyl]-3-piperidin-1-ylpropan-1-amine
CID 61019869
2-methyl-N-[(3-methylphenyl)methyl]-3-piperidin-1-ylpropan-1-amine
CID 54893417
N-[(3,5-difluorophenyl)methyl]-2-methyl-3-pyrrolidin-1-ylpropan-1-amine
CID 115767635
2-methyl-3-pyrrolidin-1-yl-N-(1,3-thiazol-4-ylmethyl)propan-1-amine
CID 61222270
4-[[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]methyl]benzonitrile
CID 60957478
2-methyl-3-pyrrolidin-1-yl-N-(2-pyrrolidin-1-ylethyl)propan-1-amine
CID 107911598

Frequently Asked Questions

What is the IUPAC name of 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine?
The IUPAC name of 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine (CID 66387783) is 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine.
What is the SMILES notation for 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine?
The canonical SMILES for 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine is CC(CNCc1sccc1N)CN1CCCCC1.
What is the InChIKey of 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine?
The InChIKey is XASFZNGTHDFVPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-12(11-17-6-3-2-4-7-17)9-16-10-14-13(15)5-8-18-14/h5,8,12,16H,2-4,6-7,9-11,15H2,1H3.
What are the key properties of 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine?
2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine has a molecular weight of 267.44 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2-methyl-3-piperidin-1-ylpropyl)amino]methyl]thiophen-3-amine is sourced from PubChem (CID 66387783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).