[(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide

C5H9N3P- — CID 163982597

IUPAC[(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide
SMILES[N-]=C1CN(P)C/C1=C/N
InChIInChI=1S/C5H9N3P/c6-1-4-2-8(9)3-5(4)7/h1H,2-3,6,9H2/q-1/b4-1-
InChIKeySZRSMDUHNSHYJF-RJRFIUFISA-N
MW142.12 g/mol
LogP-0.05
Rot. Bonds

About [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide

[(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide (PubChem CID 163982597) has the molecular formula C5H9N3P- and a molecular weight of 142.12 g/mol. Its IUPAC name is [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide.

Molecular Properties

Compound Name[(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide
PubChem CID163982597
Molecular FormulaC5H9N3P-
Molecular Weight142.12 g/mol
Exact Mass142.05
IUPAC Name[(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide
SMILES[N-]=C1CN(P)C/C1=C/N
InChIInChI=1S/C5H9N3P/c6-1-4-2-8(9)3-5(4)7/h1H,2-3,6,9H2/q-1/b4-1-
InChIKeySZRSMDUHNSHYJF-RJRFIUFISA-N
XLogP-0.05
TPSA51.56 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.12
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide?
The IUPAC name of [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide (CID 163982597) is [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide.
What is the SMILES notation for [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide?
The canonical SMILES for [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide is [N-]=C1CN(P)C/C1=C/N.
What is the InChIKey of [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide?
The InChIKey is SZRSMDUHNSHYJF-RJRFIUFISA-N. The full InChI is InChI=1S/C5H9N3P/c6-1-4-2-8(9)3-5(4)7/h1H,2-3,6,9H2/q-1/b4-1-.
What are the key properties of [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide?
[(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide has a molecular weight of 142.12 g/mol, XLogP of -0.05, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4Z)-4-(aminomethylidene)-1-phosphanylpyrrolidin-3-ylidene]azanide is sourced from PubChem (CID 163982597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).