1-phosphanylpyrrolo[2,3-b]pyridin-5-amine

C7H8N3P — CID 59593318

IUPAC1-phosphanylpyrrolo[2,3-b]pyridin-5-amine
SMILESNc1cnc2c(ccn2P)c1
InChIInChI=1S/C7H8N3P/c8-6-3-5-1-2-10(11)7(5)9-4-6/h1-4H,8,11H2
InChIKeySABIOHPJNBVILT-UHFFFAOYSA-N
MW165.14 g/mol
LogP1.26
Rot. Bonds

About 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine

1-phosphanylpyrrolo[2,3-b]pyridin-5-amine (PubChem CID 59593318) has the molecular formula C7H8N3P and a molecular weight of 165.14 g/mol. Its IUPAC name is 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine.

Molecular Properties

Compound Name1-phosphanylpyrrolo[2,3-b]pyridin-5-amine
PubChem CID59593318
Molecular FormulaC7H8N3P
Molecular Weight165.14 g/mol
Exact Mass165.05
IUPAC Name1-phosphanylpyrrolo[2,3-b]pyridin-5-amine
SMILESNc1cnc2c(ccn2P)c1
InChIInChI=1S/C7H8N3P/c8-6-3-5-1-2-10(11)7(5)9-4-6/h1-4H,8,11H2
InChIKeySABIOHPJNBVILT-UHFFFAOYSA-N
XLogP1.26
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.14
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine?
The IUPAC name of 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine (CID 59593318) is 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine.
What is the SMILES notation for 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine?
The canonical SMILES for 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine is Nc1cnc2c(ccn2P)c1.
What is the InChIKey of 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine?
The InChIKey is SABIOHPJNBVILT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N3P/c8-6-3-5-1-2-10(11)7(5)9-4-6/h1-4H,8,11H2.
What are the key properties of 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine?
1-phosphanylpyrrolo[2,3-b]pyridin-5-amine has a molecular weight of 165.14 g/mol, XLogP of 1.26, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phosphanylpyrrolo[2,3-b]pyridin-5-amine is sourced from PubChem (CID 59593318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).