2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid

C8H14N4O2 — CID 46237591

IUPAC2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid
SMILESNc1ncc(CCCC(N)C(=O)O)[nH]1
InChIInChI=1S/C8H14N4O2/c9-6(7(13)14)3-1-2-5-4-11-8(10)12-5/h4,6H,1-3,9H2,(H,13,14)(H3,10,11,12)
InChIKeyKUOPJEUTHQURCW-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.27
Rot. Bonds5

About 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid

2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid (PubChem CID 46237591) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid.

Molecular Properties

Compound Name2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid
PubChem CID46237591
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid
SMILESNc1ncc(CCCC(N)C(=O)O)[nH]1
InChIInChI=1S/C8H14N4O2/c9-6(7(13)14)3-1-2-5-4-11-8(10)12-5/h4,6H,1-3,9H2,(H,13,14)(H3,10,11,12)
InChIKeyKUOPJEUTHQURCW-UHFFFAOYSA-N
XLogP-0.27
TPSA118.02 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.27
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic 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

2-amino-5-(7-bromo-2,3-dioxo-1,4-dihydroquinoxalin-5-yl)pentanoic acid
CID 174395689
2-amino-5-(4-aminopyrimidin-2-yl)pentanoic acid
CID 54058683
2-amino-5-(2-bromophenyl)pentanoic acid
CID 83664407
(2S,7S)-2,7-diaminooctanedioic acid
CID 7033159
2,6-diaminoheptanedioic acid
CID 865
5-heptadecyl-1H-imidazol-2-amine
CID 25178085
2-amino-5-(4-bromophenyl)pentanoic acid
CID 83664406
5-(5-phenylpentyl)-1H-imidazol-2-amine
CID 46848173
2-amino-5-(4-fluorophenyl)pentanoic acid
CID 83639572
2-amino-5-(3-bromophenyl)pentanoic acid
CID 83664408
(2R)-2-amino-5-(4-oxo-1,2,5-oxadiazol-3-yl)pentanoic acid
CID 46238223
(2S)-2-amino-4-(6-aminopyrimidin-4-yl)butanoic acid
CID 100963390

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid?
The IUPAC name of 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid (CID 46237591) is 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid.
What is the SMILES notation for 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid?
The canonical SMILES for 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid is Nc1ncc(CCCC(N)C(=O)O)[nH]1.
What is the InChIKey of 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid?
The InChIKey is KUOPJEUTHQURCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c9-6(7(13)14)3-1-2-5-4-11-8(10)12-5/h4,6H,1-3,9H2,(H,13,14)(H3,10,11,12).
What are the key properties of 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid?
2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid has a molecular weight of 198.23 g/mol, XLogP of -0.27, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-amino-1H-imidazol-5-yl)pentanoic acid is sourced from PubChem (CID 46237591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).