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

C12H29N2P — CID 5249817

IUPACN-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NP(NC(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H29N2P/c1-10(2,3)13-15(12(7,8)9)14-11(4,5)6/h13-14H,1-9H3
InChIKeyIWMBPXCLYIGVRY-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.87
Rot. Bonds2

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

N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine (PubChem CID 5249817) has the molecular formula C12H29N2P and a molecular weight of 232.35 g/mol. Its IUPAC name is N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine
PubChem CID5249817
Molecular FormulaC12H29N2P
Molecular Weight232.35 g/mol
Exact Mass232.21
IUPAC NameN-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NP(NC(C)(C)C)C(C)(C)C
InChIInChI=1S/C12H29N2P/c1-10(2,3)13-15(12(7,8)9)14-11(4,5)6/h13-14H,1-9H3
InChIKeyIWMBPXCLYIGVRY-UHFFFAOYSA-N
XLogP3.87
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.87
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-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine?
The IUPAC name of N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine (CID 5249817) is N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine is CC(C)(C)NP(NC(C)(C)C)C(C)(C)C.
What is the InChIKey of N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine?
The InChIKey is IWMBPXCLYIGVRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H29N2P/c1-10(2,3)13-15(12(7,8)9)14-11(4,5)6/h13-14H,1-9H3.
What are the key properties of N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine?
N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine has a molecular weight of 232.35 g/mol, XLogP of 3.87, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[tert-butyl-(tert-butylamino)phosphanyl]-2-methylpropan-2-amine is sourced from PubChem (CID 5249817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).