(2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane

C7H8N3P — CID 58001692

IUPAC(2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane
SMILESCc1cnc2c(ccn2P)n1
InChIInChI=1S/C7H8N3P/c1-5-4-8-7-6(9-5)2-3-10(7)11/h2-4H,11H2,1H3
InChIKeyIMYGPEMOPKMHSJ-UHFFFAOYSA-N
MW165.14 g/mol
LogP1.38
Rot. Bonds

About (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane

(2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane (PubChem CID 58001692) has the molecular formula C7H8N3P and a molecular weight of 165.14 g/mol. Its IUPAC name is (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane.

Molecular Properties

Compound Name(2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane
PubChem CID58001692
Molecular FormulaC7H8N3P
Molecular Weight165.14 g/mol
Exact Mass165.05
IUPAC Name(2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane
SMILESCc1cnc2c(ccn2P)n1
InChIInChI=1S/C7H8N3P/c1-5-4-8-7-6(9-5)2-3-10(7)11/h2-4H,11H2,1H3
InChIKeyIMYGPEMOPKMHSJ-UHFFFAOYSA-N
XLogP1.38
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.14
LogP ≤ 51.38
H-Bond Donors ≤ 50
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 (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane?
The IUPAC name of (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane (CID 58001692) is (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane.
What is the SMILES notation for (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane?
The canonical SMILES for (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane is Cc1cnc2c(ccn2P)n1.
What is the InChIKey of (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane?
The InChIKey is IMYGPEMOPKMHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N3P/c1-5-4-8-7-6(9-5)2-3-10(7)11/h2-4H,11H2,1H3.
What are the key properties of (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane?
(2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane has a molecular weight of 165.14 g/mol, XLogP of 1.38, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrrolo[2,3-b]pyrazin-5-yl)phosphane is sourced from PubChem (CID 58001692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).