cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid

C10H25NO2P4 — CID 143150536

IUPACcyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid
SMILESO=P(O)(CCCNPPP)CC1CCCCC1
InChIInChI=1S/C10H25NO2P4/c12-17(13,8-4-7-11-15-16-14)9-10-5-2-1-3-6-10/h10-11,15-16H,1-9,14H2,(H,12,13)
InChIKeyPULFOPJZHZJXNQ-UHFFFAOYSA-N
MW315.21 g/mol
LogP3.79
Rot. Bonds8

About cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid

cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid (PubChem CID 143150536) has the molecular formula C10H25NO2P4 and a molecular weight of 315.21 g/mol. Its IUPAC name is cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid.

Molecular Properties

Compound Namecyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid
PubChem CID143150536
Molecular FormulaC10H25NO2P4
Molecular Weight315.21 g/mol
Exact Mass315.08
IUPAC Namecyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid
SMILESO=P(O)(CCCNPPP)CC1CCCCC1
InChIInChI=1S/C10H25NO2P4/c12-17(13,8-4-7-11-15-16-14)9-10-5-2-1-3-6-10/h10-11,15-16H,1-9,14H2,(H,12,13)
InChIKeyPULFOPJZHZJXNQ-UHFFFAOYSA-N
XLogP3.79
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.21
LogP ≤ 53.79
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

cyclohexylmethyl-[3-[1-(3,4,5-trimethoxyphenyl)ethylamino]propyl]phosphinic acid
CID 67741861
cyclohexylmethylphosphonic acid;hydrate
CID 70153007
potassium;cyclohexylmethylphosphonic acid;hydride
CID 173417626
butyl(2-cyclopentylethyl)phosphinic acid
CID 134348808
2-[[2-amino-5-[3-[cyclohexylmethyl(hydroxy)phosphoryl]propyl-hydroxyamino]-5-oxopentanoyl]amino]propanoic acid
CID 87064740
cyclopentylmethyl-[(2-methylpropan-2-yl)oxymethyl]phosphinic acid
CID 130318479
(cyclohexylmethylamino)phosphonic acid
CID 166772294
[(2R)-3-[[(2S)-2-[[(2S)-2-amino-3-methylbutanoyl]amino]propanoyl]amino]-2-hydroxypropyl]-(cyclohexylmethyl)phosphinic acid
CID 11661400
(2R)-1-amino-3-[cyclohexylmethyl(methyl)phosphoryl]propan-2-ol
CID 59011201
3-cyclohexyl-N-methylpropan-1-amine
CID 3028091
[(2R)-3-[[(2R)-2-amino-3-methylbutanoyl]amino]-2-hydroxypropyl]-(cyclohexylmethyl)phosphinic acid
CID 11573547
3-cyclohexylpropylcarbamic acid
CID 54479876

Frequently Asked Questions

What is the IUPAC name of cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid?
The IUPAC name of cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid (CID 143150536) is cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid.
What is the SMILES notation for cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid?
The canonical SMILES for cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid is O=P(O)(CCCNPPP)CC1CCCCC1.
What is the InChIKey of cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid?
The InChIKey is PULFOPJZHZJXNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO2P4/c12-17(13,8-4-7-11-15-16-14)9-10-5-2-1-3-6-10/h10-11,15-16H,1-9,14H2,(H,12,13).
What are the key properties of cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid?
cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid has a molecular weight of 315.21 g/mol, XLogP of 3.79, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethyl-[3-(triphosphanylamino)propyl]phosphinic acid is sourced from PubChem (CID 143150536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).