[(2R)-2-amino-3-methylbutyl]phosphonic acid

C5H14NO3P — CID 102215252

IUPAC[(2R)-2-amino-3-methylbutyl]phosphonic acid
SMILESCC(C)[C@@H](N)CP(=O)(O)O
InChIInChI=1S/C5H14NO3P/c1-4(2)5(6)3-10(7,8)9/h4-5H,3,6H2,1-2H3,(H2,7,8,9)/t5-/m0/s1
InChIKeyLGDDRSAPWXUMBN-YFKPBYRVSA-N
MW167.14 g/mol
LogP0.15
Rot. Bonds3

About [(2R)-2-amino-3-methylbutyl]phosphonic acid

[(2R)-2-amino-3-methylbutyl]phosphonic acid (PubChem CID 102215252) has the molecular formula C5H14NO3P and a molecular weight of 167.14 g/mol. Its IUPAC name is [(2R)-2-amino-3-methylbutyl]phosphonic acid.

Molecular Properties

Compound Name[(2R)-2-amino-3-methylbutyl]phosphonic acid
PubChem CID102215252
Molecular FormulaC5H14NO3P
Molecular Weight167.14 g/mol
Exact Mass167.07
IUPAC Name[(2R)-2-amino-3-methylbutyl]phosphonic acid
SMILESCC(C)[C@@H](N)CP(=O)(O)O
InChIInChI=1S/C5H14NO3P/c1-4(2)5(6)3-10(7,8)9/h4-5H,3,6H2,1-2H3,(H2,7,8,9)/t5-/m0/s1
InChIKeyLGDDRSAPWXUMBN-YFKPBYRVSA-N
XLogP0.15
TPSA83.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.14
LogP ≤ 50.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [(2R)-2-amino-3-methylbutyl]phosphonic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2R)-2-aminopropyl]phosphonic acid
CID 92524852
[(2R)-1-phosphonopropan-2-yl]phosphonic acid
CID 7566477
1-phosphonopropan-2-ylphosphonic acid
CID 22023450
[(1R)-1-aminoethyl]phosphonic acid;hydrochloride
CID 88516256
(2-amino-3-hydroxyoctadecyl)phosphonic acid
CID 53463630
(2S,3R)-2-amino-5-methyl-3-(phosphonomethyl)hexanoic acid
CID 139090263
[5-phosphono-4-(phosphonomethyl)pentan-2-yl]phosphonic acid
CID 130302922
(2S)-2-amino-3-methylbutan-1-ol;2-amino-3-methylbutan-1-ol
CID 87115699
[(1S)-1-aminopropyl]phosphonic acid
CID 6994862
hydrazine;(1-hydroxy-2-phosphonoethyl)phosphonic acid
CID 158563250
[(2R)-3-amino-2-fluoropropyl]phosphonic acid
CID 122184355
bis(2-methylpropyl)phosphinic acid
CID 10233207

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-amino-3-methylbutyl]phosphonic acid?
The IUPAC name of [(2R)-2-amino-3-methylbutyl]phosphonic acid (CID 102215252) is [(2R)-2-amino-3-methylbutyl]phosphonic acid.
What is the SMILES notation for [(2R)-2-amino-3-methylbutyl]phosphonic acid?
The canonical SMILES for [(2R)-2-amino-3-methylbutyl]phosphonic acid is CC(C)[C@@H](N)CP(=O)(O)O.
What is the InChIKey of [(2R)-2-amino-3-methylbutyl]phosphonic acid?
The InChIKey is LGDDRSAPWXUMBN-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H14NO3P/c1-4(2)5(6)3-10(7,8)9/h4-5H,3,6H2,1-2H3,(H2,7,8,9)/t5-/m0/s1.
What are the key properties of [(2R)-2-amino-3-methylbutyl]phosphonic acid?
[(2R)-2-amino-3-methylbutyl]phosphonic acid has a molecular weight of 167.14 g/mol, XLogP of 0.15, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-amino-3-methylbutyl]phosphonic acid is sourced from PubChem (CID 102215252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).