N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine

C7H19Br2N2P — CID 134895788

IUPACN-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine
SMILESCC(C)P(Br)(Br)(N(C)C)N(C)C
InChIInChI=1S/C7H19Br2N2P/c1-7(2)12(8,9,10(3)4)11(5)6/h7H,1-6H3
InChIKeyOORFZRWFNCTIHZ-UHFFFAOYSA-N
MW322.03 g/mol
LogP3.52
Rot. Bonds3

About N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine

N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine (PubChem CID 134895788) has the molecular formula C7H19Br2N2P and a molecular weight of 322.03 g/mol. Its IUPAC name is N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine.

Molecular Properties

Compound NameN-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine
PubChem CID134895788
Molecular FormulaC7H19Br2N2P
Molecular Weight322.03 g/mol
Exact Mass319.97
IUPAC NameN-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine
SMILESCC(C)P(Br)(Br)(N(C)C)N(C)C
InChIInChI=1S/C7H19Br2N2P/c1-7(2)12(8,9,10(3)4)11(5)6/h7H,1-6H3
InChIKeyOORFZRWFNCTIHZ-UHFFFAOYSA-N
XLogP3.52
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.03
LogP ≤ 53.52
H-Bond Donors ≤ 50
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-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine?
The IUPAC name of N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine (CID 134895788) is N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine.
What is the SMILES notation for N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine?
The canonical SMILES for N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine is CC(C)P(Br)(Br)(N(C)C)N(C)C.
What is the InChIKey of N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine?
The InChIKey is OORFZRWFNCTIHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19Br2N2P/c1-7(2)12(8,9,10(3)4)11(5)6/h7H,1-6H3.
What are the key properties of N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine?
N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine has a molecular weight of 322.03 g/mol, XLogP of 3.52, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dibromo-(dimethylamino)-propan-2-yl-λ5-phosphanyl]-N-methylmethanamine is sourced from PubChem (CID 134895788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).