1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid

C7H14NO4P — CID 14556194

IUPAC1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid
SMILESCP(=O)(O)C1CCC(N)(C(=O)O)C1
InChIInChI=1S/C7H14NO4P/c1-13(11,12)5-2-3-7(8,4-5)6(9)10/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12)
InChIKeyWINXLMBVJCDWTL-UHFFFAOYSA-N
MW207.17 g/mol
LogP0.22
Rot. Bonds2

About 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid

1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid (PubChem CID 14556194) has the molecular formula C7H14NO4P and a molecular weight of 207.17 g/mol. Its IUPAC name is 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid
PubChem CID14556194
Molecular FormulaC7H14NO4P
Molecular Weight207.17 g/mol
Exact Mass207.07
IUPAC Name1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid
SMILESCP(=O)(O)C1CCC(N)(C(=O)O)C1
InChIInChI=1S/C7H14NO4P/c1-13(11,12)5-2-3-7(8,4-5)6(9)10/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12)
InChIKeyWINXLMBVJCDWTL-UHFFFAOYSA-N
XLogP0.22
TPSA100.62 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.17
LogP ≤ 50.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid (CID 14556194) is 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid is CP(=O)(O)C1CCC(N)(C(=O)O)C1.
What is the InChIKey of 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid?
The InChIKey is WINXLMBVJCDWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14NO4P/c1-13(11,12)5-2-3-7(8,4-5)6(9)10/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12).
What are the key properties of 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid?
1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid has a molecular weight of 207.17 g/mol, XLogP of 0.22, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-[hydroxy(methyl)phosphoryl]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 14556194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).