N-ethyl-N-methoxy-2-phosphanylethanamine

C5H14NOP — CID 87357434

IUPACN-ethyl-N-methoxy-2-phosphanylethanamine
SMILESCCN(CCP)OC
InChIInChI=1S/C5H14NOP/c1-3-6(7-2)4-5-8/h3-5,8H2,1-2H3
InChIKeyJNAKCTNOFXGHPU-UHFFFAOYSA-N
MW135.15 g/mol
LogP0.74
Rot. Bonds4

About N-ethyl-N-methoxy-2-phosphanylethanamine

N-ethyl-N-methoxy-2-phosphanylethanamine (PubChem CID 87357434) has the molecular formula C5H14NOP and a molecular weight of 135.15 g/mol. Its IUPAC name is N-ethyl-N-methoxy-2-phosphanylethanamine.

Molecular Properties

Compound NameN-ethyl-N-methoxy-2-phosphanylethanamine
PubChem CID87357434
Molecular FormulaC5H14NOP
Molecular Weight135.15 g/mol
Exact Mass135.08
IUPAC NameN-ethyl-N-methoxy-2-phosphanylethanamine
SMILESCCN(CCP)OC
InChIInChI=1S/C5H14NOP/c1-3-6(7-2)4-5-8/h3-5,8H2,1-2H3
InChIKeyJNAKCTNOFXGHPU-UHFFFAOYSA-N
XLogP0.74
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.15
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-[ethyl(methoxy)amino]propan-1-ol
CID 87086707
N'-ethyl-N-[3-[ethyl(methoxy)amino]propyl]-N'-methoxypropane-1,3-diamine
CID 91426007
N-ethoxy-N-(2-phosphanylethyl)propan-1-amine
CID 87618872
N-ethyl-N-methoxy-2-methylbutan-1-amine
CID 173403887
2-[ethyl(methoxy)amino]acetic acid
CID 87131030
N-(diethylaminoperoxy)-N-ethylethanamine
CID 172691752
2-[2-hydroxyethyl(methoxy)amino]ethanol
CID 86719910
diethylamino perchlorate
CID 88753558
N-ethyl-N-methanidylpropan-1-amine
CID 59691637
CID 175250581
CID 175250581
N-ethyl-N-methanidylethanamine;rhenium
CID 59858121
copper;tris(N-ethyl-N-methanidylethanamine)
CID 163917323

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methoxy-2-phosphanylethanamine?
The IUPAC name of N-ethyl-N-methoxy-2-phosphanylethanamine (CID 87357434) is N-ethyl-N-methoxy-2-phosphanylethanamine.
What is the SMILES notation for N-ethyl-N-methoxy-2-phosphanylethanamine?
The canonical SMILES for N-ethyl-N-methoxy-2-phosphanylethanamine is CCN(CCP)OC.
What is the InChIKey of N-ethyl-N-methoxy-2-phosphanylethanamine?
The InChIKey is JNAKCTNOFXGHPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14NOP/c1-3-6(7-2)4-5-8/h3-5,8H2,1-2H3.
What are the key properties of N-ethyl-N-methoxy-2-phosphanylethanamine?
N-ethyl-N-methoxy-2-phosphanylethanamine has a molecular weight of 135.15 g/mol, XLogP of 0.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methoxy-2-phosphanylethanamine is sourced from PubChem (CID 87357434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).