1-iodophosphanyl-5-methylpyrazol-3-amine

C4H7IN3P — CID 169156073

IUPAC1-iodophosphanyl-5-methylpyrazol-3-amine
SMILESCc1cc(N)nn1PI
InChIInChI=1S/C4H7IN3P/c1-3-2-4(6)7-8(3)9-5/h2,9H,1H3,(H2,6,7)
InChIKeySAAHKZRDQGTASE-UHFFFAOYSA-N
MW255.00 g/mol
LogP1.57
Rot. Bonds1

About 1-iodophosphanyl-5-methylpyrazol-3-amine

1-iodophosphanyl-5-methylpyrazol-3-amine (PubChem CID 169156073) has the molecular formula C4H7IN3P and a molecular weight of 255.00 g/mol. Its IUPAC name is 1-iodophosphanyl-5-methylpyrazol-3-amine.

Molecular Properties

Compound Name1-iodophosphanyl-5-methylpyrazol-3-amine
PubChem CID169156073
Molecular FormulaC4H7IN3P
Molecular Weight255.00 g/mol
Exact Mass254.94
IUPAC Name1-iodophosphanyl-5-methylpyrazol-3-amine
SMILESCc1cc(N)nn1PI
InChIInChI=1S/C4H7IN3P/c1-3-2-4(6)7-8(3)9-5/h2,9H,1H3,(H2,6,7)
InChIKeySAAHKZRDQGTASE-UHFFFAOYSA-N
XLogP1.57
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.00
LogP ≤ 51.57
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

iodo-[5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]phosphane
CID 166156309
5-methyl-1-methylsulfonylpyrazol-3-amine
CID 130821858
1-(1,5-dimethylpyrazol-3-yl)-5-methylpyrazol-3-amine
CID 130497130
2-(3-amino-5-methylpyrazol-1-yl)acetaldehyde
CID 135395095
1-ethyl-5-iodopyrazol-3-amine
CID 154881729
1-cycloheptyl-5-methylpyrazol-3-amine
CID 62677533
3-(3-amino-5-methylpyrazol-1-yl)-2-methylpropanamide
CID 130496612
1-(3-fluoro-5-methylphenyl)-5-methylpyrazol-3-amine
CID 102942937
2-(3-amino-5-methylpyrazol-1-yl)propanoic acid
CID 19620619
1-(2,4-dimethylphenyl)-5-methylpyrazol-3-amine
CID 62679820
5-methyl-1-(1-methylpyrazol-3-yl)pyrazol-3-amine
CID 102942950
2-[(3-amino-5-methylpyrazol-1-yl)methyl]-2-methylpropane-1,3-diol
CID 165483252

Frequently Asked Questions

What is the IUPAC name of 1-iodophosphanyl-5-methylpyrazol-3-amine?
The IUPAC name of 1-iodophosphanyl-5-methylpyrazol-3-amine (CID 169156073) is 1-iodophosphanyl-5-methylpyrazol-3-amine.
What is the SMILES notation for 1-iodophosphanyl-5-methylpyrazol-3-amine?
The canonical SMILES for 1-iodophosphanyl-5-methylpyrazol-3-amine is Cc1cc(N)nn1PI.
What is the InChIKey of 1-iodophosphanyl-5-methylpyrazol-3-amine?
The InChIKey is SAAHKZRDQGTASE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7IN3P/c1-3-2-4(6)7-8(3)9-5/h2,9H,1H3,(H2,6,7).
What are the key properties of 1-iodophosphanyl-5-methylpyrazol-3-amine?
1-iodophosphanyl-5-methylpyrazol-3-amine has a molecular weight of 255.00 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodophosphanyl-5-methylpyrazol-3-amine is sourced from PubChem (CID 169156073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).