methyl-[3-(methylamino)propyl]phosphinous acid

C5H14NOP — CID 143142651

IUPACmethyl-[3-(methylamino)propyl]phosphinous acid
SMILESCNCCCP(C)O
InChIInChI=1S/C5H14NOP/c1-6-4-3-5-8(2)7/h6-7H,3-5H2,1-2H3
InChIKeyFLEBZCVPLLQSPF-UHFFFAOYSA-N
MW135.15 g/mol
LogP0.61
Rot. Bonds4

About methyl-[3-(methylamino)propyl]phosphinous acid

methyl-[3-(methylamino)propyl]phosphinous acid (PubChem CID 143142651) has the molecular formula C5H14NOP and a molecular weight of 135.15 g/mol. Its IUPAC name is methyl-[3-(methylamino)propyl]phosphinous acid.

Molecular Properties

Compound Namemethyl-[3-(methylamino)propyl]phosphinous acid
PubChem CID143142651
Molecular FormulaC5H14NOP
Molecular Weight135.15 g/mol
Exact Mass135.08
IUPAC Namemethyl-[3-(methylamino)propyl]phosphinous acid
SMILESCNCCCP(C)O
InChIInChI=1S/C5H14NOP/c1-6-4-3-5-8(2)7/h6-7H,3-5H2,1-2H3
InChIKeyFLEBZCVPLLQSPF-UHFFFAOYSA-N
XLogP0.61
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.15
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-(methylamino)butylphosphonous acid
CID 156749454
N,N'-dimethylheptane-1,7-diamine;ethane;molecular hydrogen
CID 176578398
N,N'-dimethylethane-1,2-diamine;ethane
CID 90689080
ethane;7-(methylamino)heptan-2-one
CID 176694896
N,N'-dimethylhexane-1,6-diamine;hydrochloride
CID 154634683
ethane;N-methylbutan-1-amine;propane
CID 142092371
ethane;10-(methylamino)decan-2-one;molecular hydrogen
CID 164864463
ethane;N-methylbutan-1-amine;N-methylethanamine
CID 162138927
N-methylbutan-1-amine
CID 8068
ethane;N-[2-(methylamino)ethyl]thiohydroxylamine
CID 153374954
N,5-dimethylhex-4-en-1-amine;ethane
CID 145111229
13-(methylamino)tridecan-2-one
CID 23382037

Frequently Asked Questions

What is the IUPAC name of methyl-[3-(methylamino)propyl]phosphinous acid?
The IUPAC name of methyl-[3-(methylamino)propyl]phosphinous acid (CID 143142651) is methyl-[3-(methylamino)propyl]phosphinous acid.
What is the SMILES notation for methyl-[3-(methylamino)propyl]phosphinous acid?
The canonical SMILES for methyl-[3-(methylamino)propyl]phosphinous acid is CNCCCP(C)O.
What is the InChIKey of methyl-[3-(methylamino)propyl]phosphinous acid?
The InChIKey is FLEBZCVPLLQSPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14NOP/c1-6-4-3-5-8(2)7/h6-7H,3-5H2,1-2H3.
What are the key properties of methyl-[3-(methylamino)propyl]phosphinous acid?
methyl-[3-(methylamino)propyl]phosphinous acid has a molecular weight of 135.15 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[3-(methylamino)propyl]phosphinous acid is sourced from PubChem (CID 143142651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).