N-(5-methylthiolan-3-yl)piperidin-1-amine

C10H20N2S — CID 83006656

IUPACN-(5-methylthiolan-3-yl)piperidin-1-amine
SMILESCC1CC(NN2CCCCC2)CS1
InChIInChI=1S/C10H20N2S/c1-9-7-10(8-13-9)11-12-5-3-2-4-6-12/h9-11H,2-8H2,1H3
InChIKeyUZDMWJTXALADGP-UHFFFAOYSA-N
MW200.35 g/mol
LogP1.87
Rot. Bonds2

About N-(5-methylthiolan-3-yl)piperidin-1-amine

N-(5-methylthiolan-3-yl)piperidin-1-amine (PubChem CID 83006656) has the molecular formula C10H20N2S and a molecular weight of 200.35 g/mol. Its IUPAC name is N-(5-methylthiolan-3-yl)piperidin-1-amine.

Molecular Properties

Compound NameN-(5-methylthiolan-3-yl)piperidin-1-amine
PubChem CID83006656
Molecular FormulaC10H20N2S
Molecular Weight200.35 g/mol
Exact Mass200.13
IUPAC NameN-(5-methylthiolan-3-yl)piperidin-1-amine
SMILESCC1CC(NN2CCCCC2)CS1
InChIInChI=1S/C10H20N2S/c1-9-7-10(8-13-9)11-12-5-3-2-4-6-12/h9-11H,2-8H2,1H3
InChIKeyUZDMWJTXALADGP-UHFFFAOYSA-N
XLogP1.87
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.35
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-methylthiolan-3-yl)piperidin-1-amine?
The IUPAC name of N-(5-methylthiolan-3-yl)piperidin-1-amine (CID 83006656) is N-(5-methylthiolan-3-yl)piperidin-1-amine.
What is the SMILES notation for N-(5-methylthiolan-3-yl)piperidin-1-amine?
The canonical SMILES for N-(5-methylthiolan-3-yl)piperidin-1-amine is CC1CC(NN2CCCCC2)CS1.
What is the InChIKey of N-(5-methylthiolan-3-yl)piperidin-1-amine?
The InChIKey is UZDMWJTXALADGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2S/c1-9-7-10(8-13-9)11-12-5-3-2-4-6-12/h9-11H,2-8H2,1H3.
What are the key properties of N-(5-methylthiolan-3-yl)piperidin-1-amine?
N-(5-methylthiolan-3-yl)piperidin-1-amine has a molecular weight of 200.35 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylthiolan-3-yl)piperidin-1-amine is sourced from PubChem (CID 83006656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).