carbamoylazanium;bromide;hydrobromide

CH6Br2N2O — CID 137219787

IUPACcarbamoylazanium;bromide;hydrobromide
SMILESBr.NC([NH3+])=O.[Br-]
InChIInChI=1S/CH4N2O.2BrH/c2-1(3)4;;/h(H4,2,3,4);2*1H
InChIKeyPPYLZILJQRXYTG-UHFFFAOYSA-N
MW221.88 g/mol
LogP-4.11
Rot. Bonds

About carbamoylazanium;bromide;hydrobromide

carbamoylazanium;bromide;hydrobromide (PubChem CID 137219787) has the molecular formula CH6Br2N2O and a molecular weight of 221.88 g/mol. Its IUPAC name is carbamoylazanium;bromide;hydrobromide.

Molecular Properties

Compound Namecarbamoylazanium;bromide;hydrobromide
PubChem CID137219787
Molecular FormulaCH6Br2N2O
Molecular Weight221.88 g/mol
Exact Mass219.88
IUPAC Namecarbamoylazanium;bromide;hydrobromide
SMILESBr.NC([NH3+])=O.[Br-]
InChIInChI=1S/CH4N2O.2BrH/c2-1(3)4;;/h(H4,2,3,4);2*1H
InChIKeyPPYLZILJQRXYTG-UHFFFAOYSA-N
XLogP-4.11
TPSA70.73 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.88
LogP ≤ 5-4.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of carbamoylazanium;bromide;hydrobromide?
The IUPAC name of carbamoylazanium;bromide;hydrobromide (CID 137219787) is carbamoylazanium;bromide;hydrobromide.
What is the SMILES notation for carbamoylazanium;bromide;hydrobromide?
The canonical SMILES for carbamoylazanium;bromide;hydrobromide is Br.NC([NH3+])=O.[Br-].
What is the InChIKey of carbamoylazanium;bromide;hydrobromide?
The InChIKey is PPYLZILJQRXYTG-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4N2O.2BrH/c2-1(3)4;;/h(H4,2,3,4);2*1H.
What are the key properties of carbamoylazanium;bromide;hydrobromide?
carbamoylazanium;bromide;hydrobromide has a molecular weight of 221.88 g/mol, XLogP of -4.11, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbamoylazanium;bromide;hydrobromide is sourced from PubChem (CID 137219787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).