2-(dimethylamino)ethyl dihydrogen phosphite

C4H12NO3P — CID 21448901

IUPAC2-(dimethylamino)ethyl dihydrogen phosphite
SMILESCN(C)CCOP(O)O
InChIInChI=1S/C4H12NO3P/c1-5(2)3-4-8-9(6)7/h6-7H,3-4H2,1-2H3
InChIKeyOXFADQJPQAKVRU-UHFFFAOYSA-N
MW153.12 g/mol
LogP-0.22
Rot. Bonds4

About 2-(dimethylamino)ethyl dihydrogen phosphite

2-(dimethylamino)ethyl dihydrogen phosphite (PubChem CID 21448901) has the molecular formula C4H12NO3P and a molecular weight of 153.12 g/mol. Its IUPAC name is 2-(dimethylamino)ethyl dihydrogen phosphite.

Molecular Properties

Compound Name2-(dimethylamino)ethyl dihydrogen phosphite
PubChem CID21448901
Molecular FormulaC4H12NO3P
Molecular Weight153.12 g/mol
Exact Mass153.06
IUPAC Name2-(dimethylamino)ethyl dihydrogen phosphite
SMILESCN(C)CCOP(O)O
InChIInChI=1S/C4H12NO3P/c1-5(2)3-4-8-9(6)7/h6-7H,3-4H2,1-2H3
InChIKeyOXFADQJPQAKVRU-UHFFFAOYSA-N
XLogP-0.22
TPSA52.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.12
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[methyl-[2-(methylamino)ethyl]amino]ethyl dihydrogen phosphite
CID 143880541
2-[2-(dimethylamino)ethoxy]ethanol
CID 158737336
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 154730088
1-[2-(dimethylamino)ethoxy-methylphosphanyl]oxypropan-2-ol
CID 143585105
bis[2-(dimethylamino)ethoxy]methanethione
CID 88923851
2-(dimethylamino)ethyl hypoiodite
CID 87171077
2-[2-[2-(dimethylamino)ethoxy]ethoxy]-N,N-dimethylethanamine;ethane
CID 168987783
N,N-dimethyl-2-methylsulfanyloxyethanamine
CID 129092985
azane;hexyl dihydrogen phosphite
CID 173357133
2-(dimethylamino)ethyl N,N-dimethylcarbamate
CID 15114748
2-(dimethylamino)ethyl hydrogen sulfate
CID 12574414
acetic acid;2-methoxy-N,N-dimethylethanamine
CID 173078438

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)ethyl dihydrogen phosphite?
The IUPAC name of 2-(dimethylamino)ethyl dihydrogen phosphite (CID 21448901) is 2-(dimethylamino)ethyl dihydrogen phosphite.
What is the SMILES notation for 2-(dimethylamino)ethyl dihydrogen phosphite?
The canonical SMILES for 2-(dimethylamino)ethyl dihydrogen phosphite is CN(C)CCOP(O)O.
What is the InChIKey of 2-(dimethylamino)ethyl dihydrogen phosphite?
The InChIKey is OXFADQJPQAKVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12NO3P/c1-5(2)3-4-8-9(6)7/h6-7H,3-4H2,1-2H3.
What are the key properties of 2-(dimethylamino)ethyl dihydrogen phosphite?
2-(dimethylamino)ethyl dihydrogen phosphite has a molecular weight of 153.12 g/mol, XLogP of -0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)ethyl dihydrogen phosphite is sourced from PubChem (CID 21448901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).