2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine

C14H25N3S — CID 83987819

IUPAC2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine
SMILESCC(C)CN1CCCCC1C(CN)c1nccs1
InChIInChI=1S/C14H25N3S/c1-11(2)10-17-7-4-3-5-13(17)12(9-15)14-16-6-8-18-14/h6,8,11-13H,3-5,7,9-10,15H2,1-2H3
InChIKeyJNZIVBZZUIAXIV-UHFFFAOYSA-N
MW267.44 g/mol
LogP2.70
Rot. Bonds5

About 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine

2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine (PubChem CID 83987819) has the molecular formula C14H25N3S and a molecular weight of 267.44 g/mol. Its IUPAC name is 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine.

Molecular Properties

Compound Name2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine
PubChem CID83987819
Molecular FormulaC14H25N3S
Molecular Weight267.44 g/mol
Exact Mass267.18
IUPAC Name2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine
SMILESCC(C)CN1CCCCC1C(CN)c1nccs1
InChIInChI=1S/C14H25N3S/c1-11(2)10-17-7-4-3-5-13(17)12(9-15)14-16-6-8-18-14/h6,8,11-13H,3-5,7,9-10,15H2,1-2H3
InChIKeyJNZIVBZZUIAXIV-UHFFFAOYSA-N
XLogP2.70
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.44
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine?
The IUPAC name of 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine (CID 83987819) is 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine.
What is the SMILES notation for 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine?
The canonical SMILES for 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine is CC(C)CN1CCCCC1C(CN)c1nccs1.
What is the InChIKey of 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine?
The InChIKey is JNZIVBZZUIAXIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3S/c1-11(2)10-17-7-4-3-5-13(17)12(9-15)14-16-6-8-18-14/h6,8,11-13H,3-5,7,9-10,15H2,1-2H3.
What are the key properties of 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine?
2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine has a molecular weight of 267.44 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylpropyl)piperidin-2-yl]-2-(1,3-thiazol-2-yl)ethanamine is sourced from PubChem (CID 83987819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).