carbamimidoyl fluoride;dibromolead

CH3Br2FN2Pb — CID 175131090

IUPACcarbamimidoyl fluoride;dibromolead
SMILESBr[Pb]Br.[H]/N=C(/N)F
InChIInChI=1S/CH3FN2.2BrH.Pb/c2-1(3)4;;;/h(H3,3,4);2*1H;/q;;;+2/p-2
InChIKeyMTGZECPGXRQNQA-UHFFFAOYSA-L
MW429.06 g/mol
LogP1.16
Rot. Bonds

About carbamimidoyl fluoride;dibromolead

carbamimidoyl fluoride;dibromolead (PubChem CID 175131090) has the molecular formula CH3Br2FN2Pb and a molecular weight of 429.06 g/mol. Its IUPAC name is carbamimidoyl fluoride;dibromolead.

Molecular Properties

Compound Namecarbamimidoyl fluoride;dibromolead
PubChem CID175131090
Molecular FormulaCH3Br2FN2Pb
Molecular Weight429.06 g/mol
Exact Mass427.84
IUPAC Namecarbamimidoyl fluoride;dibromolead
SMILESBr[Pb]Br.[H]/N=C(/N)F
InChIInChI=1S/CH3FN2.2BrH.Pb/c2-1(3)4;;;/h(H3,3,4);2*1H;/q;;;+2/p-2
InChIKeyMTGZECPGXRQNQA-UHFFFAOYSA-L
XLogP1.16
TPSA49.87 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.06
LogP ≤ 51.16
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'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbamimidoyl fluoride;dibromolead?
The IUPAC name of carbamimidoyl fluoride;dibromolead (CID 175131090) is carbamimidoyl fluoride;dibromolead.
What is the SMILES notation for carbamimidoyl fluoride;dibromolead?
The canonical SMILES for carbamimidoyl fluoride;dibromolead is Br[Pb]Br.[H]/N=C(/N)F.
What is the InChIKey of carbamimidoyl fluoride;dibromolead?
The InChIKey is MTGZECPGXRQNQA-UHFFFAOYSA-L. The full InChI is InChI=1S/CH3FN2.2BrH.Pb/c2-1(3)4;;;/h(H3,3,4);2*1H;/q;;;+2/p-2.
What are the key properties of carbamimidoyl fluoride;dibromolead?
carbamimidoyl fluoride;dibromolead has a molecular weight of 429.06 g/mol, XLogP of 1.16, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbamimidoyl fluoride;dibromolead is sourced from PubChem (CID 175131090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).