bis(piperidine);hydrate

C10H24N2O — CID 18621621

IUPACbis(piperidine);hydrate
SMILESC1CCNCC1.C1CCNCC1.O
InChIInChI=1S/2C5H11N.H2O/c2*1-2-4-6-5-3-1;/h2*6H,1-5H2;1H2
InChIKeyKYNOOMYEIULABK-UHFFFAOYSA-N
MW188.31 g/mol
LogP0.70
Rot. Bonds

About bis(piperidine);hydrate

bis(piperidine);hydrate (PubChem CID 18621621) has the molecular formula C10H24N2O and a molecular weight of 188.31 g/mol. Its IUPAC name is bis(piperidine);hydrate.

Molecular Properties

Compound Namebis(piperidine);hydrate
PubChem CID18621621
Molecular FormulaC10H24N2O
Molecular Weight188.31 g/mol
Exact Mass188.19
IUPAC Namebis(piperidine);hydrate
SMILESC1CCNCC1.C1CCNCC1.O
InChIInChI=1S/2C5H11N.H2O/c2*1-2-4-6-5-3-1;/h2*6H,1-5H2;1H2
InChIKeyKYNOOMYEIULABK-UHFFFAOYSA-N
XLogP0.70
TPSA55.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1,4'-Bipiperidine
CID 78607
N,N'-di(piperidin-4-yl)propane-1,3-diamine
CID 10105716
N,N'-di(piperidin-4-yl)butane-1,4-diamine
CID 10244061
Piperidine, compd. with tin hexachloride (2:1)
CID 3053397
1-(2-Piperidin-1-yl-ethyl)-piperazine
CID 2737212
1-(3-Piperidinopropyl)piperazine
CID 2737253
Piperidine tetrathiotungstate
CID 22836482
Piperazino-piperidine
CID 15251992
4,4-Difluoropiperidine;4-fluoropiperidine
CID 70094728
Carbon monoxide;molybdenum;bis(piperidine)
CID 10937722
Bispiperidinium bromide
CID 129800859
4-Methylpiperidine_hemihydrate
CID 168341868

Frequently Asked Questions

What is the IUPAC name of bis(piperidine);hydrate?
The IUPAC name of bis(piperidine);hydrate (CID 18621621) is bis(piperidine);hydrate.
What is the SMILES notation for bis(piperidine);hydrate?
The canonical SMILES for bis(piperidine);hydrate is C1CCNCC1.C1CCNCC1.O.
What is the InChIKey of bis(piperidine);hydrate?
The InChIKey is KYNOOMYEIULABK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H11N.H2O/c2*1-2-4-6-5-3-1;/h2*6H,1-5H2;1H2.
What are the key properties of bis(piperidine);hydrate?
bis(piperidine);hydrate has a molecular weight of 188.31 g/mol, XLogP of 0.70, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(piperidine);hydrate is sourced from PubChem (CID 18621621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).