[(4R)-4-aminopentyl]phosphonic acid

C5H14NO3P — CID 16760131

IUPAC[(4R)-4-aminopentyl]phosphonic acid
SMILESC[C@@H](N)CCCP(=O)(O)O
InChIInChI=1S/C5H14NO3P/c1-5(6)3-2-4-10(7,8)9/h5H,2-4,6H2,1H3,(H2,7,8,9)/t5-/m1/s1
InChIKeyRCUUZWBKMBNAIA-RXMQYKEDSA-N
MW167.15 g/mol
LogP0.29
Rot. Bonds4

About [(4R)-4-aminopentyl]phosphonic acid

[(4R)-4-aminopentyl]phosphonic acid (PubChem CID 16760131) has the molecular formula C5H14NO3P and a molecular weight of 167.15 g/mol. Its IUPAC name is [(4R)-4-aminopentyl]phosphonic acid.

Molecular Properties

Compound Name[(4R)-4-aminopentyl]phosphonic acid
PubChem CID16760131
Molecular FormulaC5H14NO3P
Molecular Weight167.15 g/mol
Exact Mass167.07
IUPAC Name[(4R)-4-aminopentyl]phosphonic acid
SMILESC[C@@H](N)CCCP(=O)(O)O
InChIInChI=1S/C5H14NO3P/c1-5(6)3-2-4-10(7,8)9/h5H,2-4,6H2,1H3,(H2,7,8,9)/t5-/m1/s1
InChIKeyRCUUZWBKMBNAIA-RXMQYKEDSA-N
XLogP0.29
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.15
LogP ≤ 50.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(4R)-4-aminopentyl]phosphonic acid?
The IUPAC name of [(4R)-4-aminopentyl]phosphonic acid (CID 16760131) is [(4R)-4-aminopentyl]phosphonic acid.
What is the SMILES notation for [(4R)-4-aminopentyl]phosphonic acid?
The canonical SMILES for [(4R)-4-aminopentyl]phosphonic acid is C[C@@H](N)CCCP(=O)(O)O.
What is the InChIKey of [(4R)-4-aminopentyl]phosphonic acid?
The InChIKey is RCUUZWBKMBNAIA-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H14NO3P/c1-5(6)3-2-4-10(7,8)9/h5H,2-4,6H2,1H3,(H2,7,8,9)/t5-/m1/s1.
What are the key properties of [(4R)-4-aminopentyl]phosphonic acid?
[(4R)-4-aminopentyl]phosphonic acid has a molecular weight of 167.15 g/mol, XLogP of 0.29, 4 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-4-aminopentyl]phosphonic acid is sourced from PubChem (CID 16760131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).