(Z,2S)-2-amino-5-iodopent-4-enoic acid

C5H8INO2 — CID 92531833

IUPAC(Z,2S)-2-amino-5-iodopent-4-enoic acid
SMILESN[C@@H](C/C=C\I)C(=O)O
InChIInChI=1S/C5H8INO2/c6-3-1-2-4(7)5(8)9/h1,3-4H,2,7H2,(H,8,9)/b3-1-/t4-/m0/s1
InChIKeyUBWNTRIQQQVOBY-HNHRSYQESA-N
MW241.03 g/mol
LogP0.74
Rot. Bonds3

About (Z,2S)-2-amino-5-iodopent-4-enoic acid

(Z,2S)-2-amino-5-iodopent-4-enoic acid (PubChem CID 92531833) has the molecular formula C5H8INO2 and a molecular weight of 241.03 g/mol. Its IUPAC name is (Z,2S)-2-amino-5-iodopent-4-enoic acid.

Molecular Properties

Compound Name(Z,2S)-2-amino-5-iodopent-4-enoic acid
PubChem CID92531833
Molecular FormulaC5H8INO2
Molecular Weight241.03 g/mol
Exact Mass240.96
IUPAC Name(Z,2S)-2-amino-5-iodopent-4-enoic acid
SMILESN[C@@H](C/C=C\I)C(=O)O
InChIInChI=1S/C5H8INO2/c6-3-1-2-4(7)5(8)9/h1,3-4H,2,7H2,(H,8,9)/b3-1-/t4-/m0/s1
InChIKeyUBWNTRIQQQVOBY-HNHRSYQESA-N
XLogP0.74
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.03
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (Z,2S)-2-amino-5-iodopent-4-enoic 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

(Z)-2,7-diaminooct-4-enedioic acid
CID 90205978
(Z,2S)-2-aminohex-4-enoic acid
CID 91998876
(E,2S)-2-amino-6,6-dimethylhept-4-enoic acid
CID 58150151
(E)-2-amino-5-(diaminomethylideneamino)pent-4-enoic acid
CID 130144807
(2S)-2-amino-5-methylsulfonylpent-4-enoic acid
CID 174239098
(E)-2,6-diamino-2-methylhept-3-enedioic acid
CID 22297949
(Z,3S,8S)-3,8-diaminodec-5-ene-2,9-dione
CID 166997414
2-aminopent-4-enoic acid;cyclohexane
CID 174929503
(2S,5S)-2,5-diaminohexanedioic acid
CID 22871875
2-amino-5-pyridin-4-ylpent-4-enoic acid
CID 67375664
[(3S)-3-amino-3-carboxypropylidene]-methyl-oxidophosphanium
CID 176891524
2-amino-3-[(2-amino-2-carboxyethyl)diselanyl]propanoic acid
CID 15104

Frequently Asked Questions

What is the IUPAC name of (Z,2S)-2-amino-5-iodopent-4-enoic acid?
The IUPAC name of (Z,2S)-2-amino-5-iodopent-4-enoic acid (CID 92531833) is (Z,2S)-2-amino-5-iodopent-4-enoic acid.
What is the SMILES notation for (Z,2S)-2-amino-5-iodopent-4-enoic acid?
The canonical SMILES for (Z,2S)-2-amino-5-iodopent-4-enoic acid is N[C@@H](C/C=C\I)C(=O)O.
What is the InChIKey of (Z,2S)-2-amino-5-iodopent-4-enoic acid?
The InChIKey is UBWNTRIQQQVOBY-HNHRSYQESA-N. The full InChI is InChI=1S/C5H8INO2/c6-3-1-2-4(7)5(8)9/h1,3-4H,2,7H2,(H,8,9)/b3-1-/t4-/m0/s1.
What are the key properties of (Z,2S)-2-amino-5-iodopent-4-enoic acid?
(Z,2S)-2-amino-5-iodopent-4-enoic acid has a molecular weight of 241.03 g/mol, XLogP of 0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,2S)-2-amino-5-iodopent-4-enoic acid is sourced from PubChem (CID 92531833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).