N,N-diethylethanamine;propan-2-ylphosphane

C9H24NP — CID 88654253

IUPACN,N-diethylethanamine;propan-2-ylphosphane
SMILESCC(C)P.CCN(CC)CC
InChIInChI=1S/C6H15N.C3H9P/c1-4-7(5-2)6-3;1-3(2)4/h4-6H2,1-3H3;3H,4H2,1-2H3
InChIKeyMIXVBSYYXQLGEK-UHFFFAOYSA-N
MW177.27 g/mol
LogP2.62
Rot. Bonds3

About N,N-diethylethanamine;propan-2-ylphosphane

N,N-diethylethanamine;propan-2-ylphosphane (PubChem CID 88654253) has the molecular formula C9H24NP and a molecular weight of 177.27 g/mol. Its IUPAC name is N,N-diethylethanamine;propan-2-ylphosphane.

Molecular Properties

Compound NameN,N-diethylethanamine;propan-2-ylphosphane
PubChem CID88654253
Molecular FormulaC9H24NP
Molecular Weight177.27 g/mol
Exact Mass177.16
IUPAC NameN,N-diethylethanamine;propan-2-ylphosphane
SMILESCC(C)P.CCN(CC)CC
InChIInChI=1S/C6H15N.C3H9P/c1-4-7(5-2)6-3;1-3(2)4/h4-6H2,1-3H3;3H,4H2,1-2H3
InChIKeyMIXVBSYYXQLGEK-UHFFFAOYSA-N
XLogP2.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethylethanamine;ethane
CID 22114990
N,N-diethylethanamine;propan-2-amine
CID 19095085
N,N-diethylethanamine;N,N-dimethylmethanamine;hydrobromide
CID 174858391
N,N-diethylethanamine;N,N-dimethylethanamine
CID 87629474
N,N-diethylethanamine;palladium(2+)
CID 22219787
CID 175820473
CID 175820473
N,N-diethylethanamine chloride
CID 22292735
bis(N,N-diethylethanamine);dihydrate
CID 173331052
ethane;propan-2-ylphosphane
CID 170611311
N,N-diethylethanamine;1,1-dimethylhydrazine
CID 87141357
alumane;N,N-diethylethanamine;hydrochloride
CID 173388642
N,N-diethylethanamine;ethene
CID 90857968

Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;propan-2-ylphosphane?
The IUPAC name of N,N-diethylethanamine;propan-2-ylphosphane (CID 88654253) is N,N-diethylethanamine;propan-2-ylphosphane.
What is the SMILES notation for N,N-diethylethanamine;propan-2-ylphosphane?
The canonical SMILES for N,N-diethylethanamine;propan-2-ylphosphane is CC(C)P.CCN(CC)CC.
What is the InChIKey of N,N-diethylethanamine;propan-2-ylphosphane?
The InChIKey is MIXVBSYYXQLGEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15N.C3H9P/c1-4-7(5-2)6-3;1-3(2)4/h4-6H2,1-3H3;3H,4H2,1-2H3.
What are the key properties of N,N-diethylethanamine;propan-2-ylphosphane?
N,N-diethylethanamine;propan-2-ylphosphane has a molecular weight of 177.27 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;propan-2-ylphosphane is sourced from PubChem (CID 88654253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).