7-iodo-6-phosphanylquinazolin-4-amine

C8H7IN3P — CID 142919294

IUPAC7-iodo-6-phosphanylquinazolin-4-amine
SMILESNc1ncnc2cc(I)c(P)cc12
InChIInChI=1S/C8H7IN3P/c9-5-2-6-4(1-7(5)13)8(10)12-3-11-6/h1-3H,13H2,(H2,10,11,12)
InChIKeyHZDKEUWDADNGPZ-UHFFFAOYSA-N
MW303.04 g/mol
LogP1.32
Rot. Bonds

About 7-iodo-6-phosphanylquinazolin-4-amine

7-iodo-6-phosphanylquinazolin-4-amine (PubChem CID 142919294) has the molecular formula C8H7IN3P and a molecular weight of 303.04 g/mol. Its IUPAC name is 7-iodo-6-phosphanylquinazolin-4-amine.

Molecular Properties

Compound Name7-iodo-6-phosphanylquinazolin-4-amine
PubChem CID142919294
Molecular FormulaC8H7IN3P
Molecular Weight303.04 g/mol
Exact Mass302.94
IUPAC Name7-iodo-6-phosphanylquinazolin-4-amine
SMILESNc1ncnc2cc(I)c(P)cc12
InChIInChI=1S/C8H7IN3P/c9-5-2-6-4(1-7(5)13)8(10)12-3-11-6/h1-3H,13H2,(H2,10,11,12)
InChIKeyHZDKEUWDADNGPZ-UHFFFAOYSA-N
XLogP1.32
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.04
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6,7-dimethylquinazolin-4-amine;ethane
CID 142177634
2,3-dihydro-1H-imidazo[4,5-g]quinazolin-8-amine
CID 142489178
2,3-dihydro-1H-imidazo[4,5-g]quinazolin-8-amine;ethane
CID 142489177
6,7-ditert-butylquinazolin-4-amine
CID 59066322
6-methoxyquinazoline-4,7-diamine
CID 142061671
4-amino-6-methoxyquinazolin-7-ol
CID 135697903
6-tert-butylquinazolin-4-amine
CID 58008725
7-fluoro-6-pyrimidin-5-ylquinazolin-4-amine
CID 139454412
azane;quinazolin-4-amine
CID 172800040
hydron;quinazolin-4-amine
CID 174478214
7-methoxy-6-propan-2-yloxyquinazolin-4-amine
CID 141299467
6-(trifluoromethoxy)quinazolin-4-amine
CID 156900146

Frequently Asked Questions

What is the IUPAC name of 7-iodo-6-phosphanylquinazolin-4-amine?
The IUPAC name of 7-iodo-6-phosphanylquinazolin-4-amine (CID 142919294) is 7-iodo-6-phosphanylquinazolin-4-amine.
What is the SMILES notation for 7-iodo-6-phosphanylquinazolin-4-amine?
The canonical SMILES for 7-iodo-6-phosphanylquinazolin-4-amine is Nc1ncnc2cc(I)c(P)cc12.
What is the InChIKey of 7-iodo-6-phosphanylquinazolin-4-amine?
The InChIKey is HZDKEUWDADNGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7IN3P/c9-5-2-6-4(1-7(5)13)8(10)12-3-11-6/h1-3H,13H2,(H2,10,11,12).
What are the key properties of 7-iodo-6-phosphanylquinazolin-4-amine?
7-iodo-6-phosphanylquinazolin-4-amine has a molecular weight of 303.04 g/mol, XLogP of 1.32, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-iodo-6-phosphanylquinazolin-4-amine is sourced from PubChem (CID 142919294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).