piperidine-1-carboximidamide;hydrobromide

C6H14BrN3 — CID 2777304

IUPACpiperidine-1-carboximidamide;hydrobromide
SMILESBr.[H]/N=C(\N)N1CCCCC1
InChIInChI=1S/C6H13N3.BrH/c7-6(8)9-4-2-1-3-5-9;/h1-5H2,(H3,7,8);1H
InChIKeyUOTPMDPAIHTZNH-UHFFFAOYSA-N
MW208.10 g/mol
LogP0.94
Rot. Bonds

About piperidine-1-carboximidamide;hydrobromide

piperidine-1-carboximidamide;hydrobromide (PubChem CID 2777304) has the molecular formula C6H14BrN3 and a molecular weight of 208.10 g/mol. Its IUPAC name is piperidine-1-carboximidamide;hydrobromide.

Molecular Properties

Compound Namepiperidine-1-carboximidamide;hydrobromide
PubChem CID2777304
Molecular FormulaC6H14BrN3
Molecular Weight208.10 g/mol
Exact Mass207.04
IUPAC Namepiperidine-1-carboximidamide;hydrobromide
SMILESBr.[H]/N=C(\N)N1CCCCC1
InChIInChI=1S/C6H13N3.BrH/c7-6(8)9-4-2-1-3-5-9;/h1-5H2,(H3,7,8);1H
InChIKeyUOTPMDPAIHTZNH-UHFFFAOYSA-N
XLogP0.94
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.10
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of piperidine-1-carboximidamide;hydrobromide?
The IUPAC name of piperidine-1-carboximidamide;hydrobromide (CID 2777304) is piperidine-1-carboximidamide;hydrobromide.
What is the SMILES notation for piperidine-1-carboximidamide;hydrobromide?
The canonical SMILES for piperidine-1-carboximidamide;hydrobromide is Br.[H]/N=C(\N)N1CCCCC1.
What is the InChIKey of piperidine-1-carboximidamide;hydrobromide?
The InChIKey is UOTPMDPAIHTZNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3.BrH/c7-6(8)9-4-2-1-3-5-9;/h1-5H2,(H3,7,8);1H.
What are the key properties of piperidine-1-carboximidamide;hydrobromide?
piperidine-1-carboximidamide;hydrobromide has a molecular weight of 208.10 g/mol, XLogP of 0.94, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for piperidine-1-carboximidamide;hydrobromide is sourced from PubChem (CID 2777304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).