bis(piperidine);urea

C11H26N4O — CID 21223922

IUPACbis(piperidine);urea
SMILESC1CCNCC1.C1CCNCC1.NC(N)=O
InChIInChI=1S/2C5H11N.CH4N2O/c2*1-2-4-6-5-3-1;2-1(3)4/h2*6H,1-5H2;(H4,2,3,4)
InChIKeyQICRRCVRQJDEJK-UHFFFAOYSA-N
MW230.36 g/mol
LogP0.54
Rot. Bonds

About bis(piperidine);urea

bis(piperidine);urea (PubChem CID 21223922) has the molecular formula C11H26N4O and a molecular weight of 230.36 g/mol. Its IUPAC name is bis(piperidine);urea.

Molecular Properties

Compound Namebis(piperidine);urea
PubChem CID21223922
Molecular FormulaC11H26N4O
Molecular Weight230.36 g/mol
Exact Mass230.21
IUPAC Namebis(piperidine);urea
SMILESC1CCNCC1.C1CCNCC1.NC(N)=O
InChIInChI=1S/2C5H11N.CH4N2O/c2*1-2-4-6-5-3-1;2-1(3)4/h2*6H,1-5H2;(H4,2,3,4)
InChIKeyQICRRCVRQJDEJK-UHFFFAOYSA-N
XLogP0.54
TPSA93.17 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.36
LogP ≤ 50.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of bis(piperidine);urea?
The IUPAC name of bis(piperidine);urea (CID 21223922) is bis(piperidine);urea.
What is the SMILES notation for bis(piperidine);urea?
The canonical SMILES for bis(piperidine);urea is C1CCNCC1.C1CCNCC1.NC(N)=O.
What is the InChIKey of bis(piperidine);urea?
The InChIKey is QICRRCVRQJDEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H11N.CH4N2O/c2*1-2-4-6-5-3-1;2-1(3)4/h2*6H,1-5H2;(H4,2,3,4).
What are the key properties of bis(piperidine);urea?
bis(piperidine);urea has a molecular weight of 230.36 g/mol, XLogP of 0.54, 0 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(piperidine);urea is sourced from PubChem (CID 21223922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).