N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine

C8H20NO2P — CID 5171659

IUPACN-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine
SMILESCOP(OC)N(C(C)C)C(C)C
InChIInChI=1S/C8H20NO2P/c1-7(2)9(8(3)4)12(10-5)11-6/h7-8H,1-6H3
InChIKeyKXUMNSXPAYCKPR-UHFFFAOYSA-N
MW193.23 g/mol
LogP2.62
Rot. Bonds5

About N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine

N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine (PubChem CID 5171659) has the molecular formula C8H20NO2P and a molecular weight of 193.23 g/mol. Its IUPAC name is N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine
PubChem CID5171659
Molecular FormulaC8H20NO2P
Molecular Weight193.23 g/mol
Exact Mass193.12
IUPAC NameN-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine
SMILESCOP(OC)N(C(C)C)C(C)C
InChIInChI=1S/C8H20NO2P/c1-7(2)9(8(3)4)12(10-5)11-6/h7-8H,1-6H3
InChIKeyKXUMNSXPAYCKPR-UHFFFAOYSA-N
XLogP2.62
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.23
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine (CID 5171659) is N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine is COP(OC)N(C(C)C)C(C)C.
What is the InChIKey of N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
The InChIKey is KXUMNSXPAYCKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20NO2P/c1-7(2)9(8(3)4)12(10-5)11-6/h7-8H,1-6H3.
What are the key properties of N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine?
N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine has a molecular weight of 193.23 g/mol, XLogP of 2.62, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dimethoxyphosphanyl-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 5171659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).