N-(2-piperidin-1-ylpropyl)thiolan-3-amine

C12H24N2S — CID 61011012

IUPACN-(2-piperidin-1-ylpropyl)thiolan-3-amine
SMILESCC(CNC1CCSC1)N1CCCCC1
InChIInChI=1S/C12H24N2S/c1-11(14-6-3-2-4-7-14)9-13-12-5-8-15-10-12/h11-13H,2-10H2,1H3
InChIKeyZWCOYQHIUHFKKD-UHFFFAOYSA-N
MW228.40 g/mol
LogP1.96
Rot. Bonds4

About N-(2-piperidin-1-ylpropyl)thiolan-3-amine

N-(2-piperidin-1-ylpropyl)thiolan-3-amine (PubChem CID 61011012) has the molecular formula C12H24N2S and a molecular weight of 228.40 g/mol. Its IUPAC name is N-(2-piperidin-1-ylpropyl)thiolan-3-amine.

Molecular Properties

Compound NameN-(2-piperidin-1-ylpropyl)thiolan-3-amine
PubChem CID61011012
Molecular FormulaC12H24N2S
Molecular Weight228.40 g/mol
Exact Mass228.17
IUPAC NameN-(2-piperidin-1-ylpropyl)thiolan-3-amine
SMILESCC(CNC1CCSC1)N1CCCCC1
InChIInChI=1S/C12H24N2S/c1-11(14-6-3-2-4-7-14)9-13-12-5-8-15-10-12/h11-13H,2-10H2,1H3
InChIKeyZWCOYQHIUHFKKD-UHFFFAOYSA-N
XLogP1.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.40
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-piperidin-1-ylpropyl)cyclopropanamine
CID 62424338
N-[2-(azocan-1-yl)propyl]cyclopentanamine
CID 62558696
N-(2-methyl-3-piperidin-1-ylpropyl)thiolan-3-amine
CID 61020549
5-methyl-N-(2-piperidin-1-ylpropyl)thiolan-3-amine
CID 79950914
8-methyl-N-(2-piperidin-1-ylpropyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 54899357
(2S)-1-[[(3S)-thiolan-3-yl]amino]propan-2-ol
CID 93033310
N-(2-piperidin-1-ylpropyl)-3-propan-2-ylcyclohexan-1-amine
CID 107448376
(3S)-N-(2-piperidin-1-ylethyl)thiolan-3-amine
CID 758325
N-[2-(4-methylpiperazin-1-yl)propyl]cyclohexanamine
CID 62557467
N-[2-(4-methylazepan-1-yl)propyl]cyclohexanamine
CID 63627376
1,1-dioxo-N-(2-piperidin-1-ylpropyl)thian-3-amine
CID 63921831
N-(2,2-dimethoxyethyl)thiolan-3-amine
CID 60663265

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylpropyl)thiolan-3-amine?
The IUPAC name of N-(2-piperidin-1-ylpropyl)thiolan-3-amine (CID 61011012) is N-(2-piperidin-1-ylpropyl)thiolan-3-amine.
What is the SMILES notation for N-(2-piperidin-1-ylpropyl)thiolan-3-amine?
The canonical SMILES for N-(2-piperidin-1-ylpropyl)thiolan-3-amine is CC(CNC1CCSC1)N1CCCCC1.
What is the InChIKey of N-(2-piperidin-1-ylpropyl)thiolan-3-amine?
The InChIKey is ZWCOYQHIUHFKKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2S/c1-11(14-6-3-2-4-7-14)9-13-12-5-8-15-10-12/h11-13H,2-10H2,1H3.
What are the key properties of N-(2-piperidin-1-ylpropyl)thiolan-3-amine?
N-(2-piperidin-1-ylpropyl)thiolan-3-amine has a molecular weight of 228.40 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylpropyl)thiolan-3-amine is sourced from PubChem (CID 61011012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).