2,5-Diaminopentanoic Acid

C5H12N2O2 — CID 389

IUPAC2,5-diaminopentanoic acid
SMILESC(CC(C(=O)O)N)CN
InChIInChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)
InChIKeyAHLPHDHHMVZTML-UHFFFAOYSA-N
MW132.16 g/mol
LogP-4.40
Rot. Bonds4

About 2,5-Diaminopentanoic Acid

2,5-Diaminopentanoic Acid (PubChem CID 389) has the molecular formula C5H12N2O2 and a molecular weight of 132.16 g/mol. Its IUPAC name is 2,5-diaminopentanoic acid.

Molecular Properties

Compound Name2,5-Diaminopentanoic Acid
PubChem CID389
Molecular FormulaC5H12N2O2
Molecular Weight132.16 g/mol
Exact Mass132.09
IUPAC Name2,5-diaminopentanoic acid
SMILESC(CC(C(=O)O)N)CN
InChIInChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)
InChIKeyAHLPHDHHMVZTML-UHFFFAOYSA-N
XLogP-4.40
TPSA89.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity95

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 5-4.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

L-Lysine
CID 5962
L-Arginine
CID 6322
L-Glutamine
CID 5961
L-(-)-Ornithine
CID 6262
L-2-Aminoadipic Acid
CID 92136
5-Aminovaleric acid
CID 138
Caprine
CID 21236
Alpha-Aminoadipic Acid
CID 469
D-Glutamine
CID 145815
D-Lysine
CID 57449
D-Arginine
CID 71070
D-Ornithine
CID 71082

Frequently Asked Questions

What is the IUPAC name of 2,5-Diaminopentanoic Acid?
The IUPAC name of 2,5-Diaminopentanoic Acid (CID 389) is 2,5-diaminopentanoic acid.
What is the SMILES notation for 2,5-Diaminopentanoic Acid?
The canonical SMILES for 2,5-Diaminopentanoic Acid is C(CC(C(=O)O)N)CN.
What is the InChIKey of 2,5-Diaminopentanoic Acid?
The InChIKey is AHLPHDHHMVZTML-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9).
What are the key properties of 2,5-Diaminopentanoic Acid?
2,5-Diaminopentanoic Acid has a molecular weight of 132.16 g/mol, XLogP of -4.40, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-Diaminopentanoic Acid is sourced from PubChem (CID 389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).