aniline;carbanide;hafnium

C8H13HfN-2 — CID 158735732

IUPACaniline;carbanide;hafnium
SMILESNc1ccccc1.[CH3-].[CH3-].[Hf]
InChIInChI=1S/C6H7N.2CH3.Hf/c7-6-4-2-1-3-5-6;;;/h1-5H,7H2;2*1H3;/q;2*-1;
InChIKeyFUSKCPFCYKCBDH-UHFFFAOYSA-N
MW301.69 g/mol
LogP2.17
Rot. Bonds

About aniline;carbanide;hafnium

aniline;carbanide;hafnium (PubChem CID 158735732) has the molecular formula C8H13HfN-2 and a molecular weight of 301.69 g/mol. Its IUPAC name is aniline;carbanide;hafnium.

Molecular Properties

Compound Nameaniline;carbanide;hafnium
PubChem CID158735732
Molecular FormulaC8H13HfN-2
Molecular Weight301.69 g/mol
Exact Mass303.05
IUPAC Nameaniline;carbanide;hafnium
SMILESNc1ccccc1.[CH3-].[CH3-].[Hf]
InChIInChI=1S/C6H7N.2CH3.Hf/c7-6-4-2-1-3-5-6;;;/h1-5H,7H2;2*1H3;/q;2*-1;
InChIKeyFUSKCPFCYKCBDH-UHFFFAOYSA-N
XLogP2.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.69
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of aniline;carbanide;hafnium?
The IUPAC name of aniline;carbanide;hafnium (CID 158735732) is aniline;carbanide;hafnium.
What is the SMILES notation for aniline;carbanide;hafnium?
The canonical SMILES for aniline;carbanide;hafnium is Nc1ccccc1.[CH3-].[CH3-].[Hf].
What is the InChIKey of aniline;carbanide;hafnium?
The InChIKey is FUSKCPFCYKCBDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N.2CH3.Hf/c7-6-4-2-1-3-5-6;;;/h1-5H,7H2;2*1H3;/q;2*-1;.
What are the key properties of aniline;carbanide;hafnium?
aniline;carbanide;hafnium has a molecular weight of 301.69 g/mol, XLogP of 2.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aniline;carbanide;hafnium is sourced from PubChem (CID 158735732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).