methylphosphane;1H-pyrrolo[3,2-b]pyridine

C8H11N2P — CID 142512475

IUPACmethylphosphane;1H-pyrrolo[3,2-b]pyridine
SMILESCP.c1cnc2cc[nH]c2c1
InChIInChI=1S/C7H6N2.CH5P/c1-2-6-7(8-4-1)3-5-9-6;1-2/h1-5,9H;2H2,1H3
InChIKeyYEKVNVQYGKSGGK-UHFFFAOYSA-N
MW166.16 g/mol
LogP2.05
Rot. Bonds

About methylphosphane;1H-pyrrolo[3,2-b]pyridine

methylphosphane;1H-pyrrolo[3,2-b]pyridine (PubChem CID 142512475) has the molecular formula C8H11N2P and a molecular weight of 166.16 g/mol. Its IUPAC name is methylphosphane;1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Namemethylphosphane;1H-pyrrolo[3,2-b]pyridine
PubChem CID142512475
Molecular FormulaC8H11N2P
Molecular Weight166.16 g/mol
Exact Mass166.07
IUPAC Namemethylphosphane;1H-pyrrolo[3,2-b]pyridine
SMILESCP.c1cnc2cc[nH]c2c1
InChIInChI=1S/C7H6N2.CH5P/c1-2-6-7(8-4-1)3-5-9-6;1-2/h1-5,9H;2H2,1H3
InChIKeyYEKVNVQYGKSGGK-UHFFFAOYSA-N
XLogP2.05
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.16
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methylphosphane;1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of methylphosphane;1H-pyrrolo[3,2-b]pyridine (CID 142512475) is methylphosphane;1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for methylphosphane;1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for methylphosphane;1H-pyrrolo[3,2-b]pyridine is CP.c1cnc2cc[nH]c2c1.
What is the InChIKey of methylphosphane;1H-pyrrolo[3,2-b]pyridine?
The InChIKey is YEKVNVQYGKSGGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2.CH5P/c1-2-6-7(8-4-1)3-5-9-6;1-2/h1-5,9H;2H2,1H3.
What are the key properties of methylphosphane;1H-pyrrolo[3,2-b]pyridine?
methylphosphane;1H-pyrrolo[3,2-b]pyridine has a molecular weight of 166.16 g/mol, XLogP of 2.05, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methylphosphane;1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 142512475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).