N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine

C8H20F3N2P — CID 23237600

IUPACN-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NP(F)(F)(F)NC(C)(C)C
InChIInChI=1S/C8H20F3N2P/c1-7(2,3)12-14(9,10,11)13-8(4,5)6/h12-13H,1-6H3
InChIKeyVBHTWIKTCLGWFR-UHFFFAOYSA-N
MW232.23 g/mol
LogP3.80
Rot. Bonds2

About N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine

N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine (PubChem CID 23237600) has the molecular formula C8H20F3N2P and a molecular weight of 232.23 g/mol. Its IUPAC name is N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine
PubChem CID23237600
Molecular FormulaC8H20F3N2P
Molecular Weight232.23 g/mol
Exact Mass232.13
IUPAC NameN-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NP(F)(F)(F)NC(C)(C)C
InChIInChI=1S/C8H20F3N2P/c1-7(2,3)12-14(9,10,11)13-8(4,5)6/h12-13H,1-6H3
InChIKeyVBHTWIKTCLGWFR-UHFFFAOYSA-N
XLogP3.80
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.23
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine (CID 23237600) is N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine is CC(C)(C)NP(F)(F)(F)NC(C)(C)C.
What is the InChIKey of N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine?
The InChIKey is VBHTWIKTCLGWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20F3N2P/c1-7(2,3)12-14(9,10,11)13-8(4,5)6/h12-13H,1-6H3.
What are the key properties of N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine?
N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine has a molecular weight of 232.23 g/mol, XLogP of 3.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(tert-butylamino)-trifluoro-λ5-phosphanyl]-2-methylpropan-2-amine is sourced from PubChem (CID 23237600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).