azane;3,5-diaminopentanoic acid

C5H15N3O2 — CID 173202896

IUPACazane;3,5-diaminopentanoic acid
SMILESN.NCCC(N)CC(=O)O
InChIInChI=1S/C5H12N2O2.H3N/c6-2-1-4(7)3-5(8)9;/h4H,1-3,6-7H2,(H,8,9);1H3
InChIKeyUKULVBRUBNYSEM-UHFFFAOYSA-N
MW149.19 g/mol
LogP-0.70
Rot. Bonds4

About azane;3,5-diaminopentanoic acid

azane;3,5-diaminopentanoic acid (PubChem CID 173202896) has the molecular formula C5H15N3O2 and a molecular weight of 149.19 g/mol. Its IUPAC name is azane;3,5-diaminopentanoic acid.

Molecular Properties

Compound Nameazane;3,5-diaminopentanoic acid
PubChem CID173202896
Molecular FormulaC5H15N3O2
Molecular Weight149.19 g/mol
Exact Mass149.12
IUPAC Nameazane;3,5-diaminopentanoic acid
SMILESN.NCCC(N)CC(=O)O
InChIInChI=1S/C5H12N2O2.H3N/c6-2-1-4(7)3-5(8)9;/h4H,1-3,6-7H2,(H,8,9);1H3
InChIKeyUKULVBRUBNYSEM-UHFFFAOYSA-N
XLogP-0.70
TPSA124.34 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 5-0.70
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze azane;3,5-diaminopentanoic 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

azane;3,5-diaminopentanoic acid;iron;hydrate
CID 173139840
(3R)-3,6-diaminohexanoic acid;3,6-diaminohexanoic acid
CID 87126167
3,7-diaminoheptanoic acid
CID 4695301
(3R)-3,7-diaminoheptanoic acid;dihydrochloride
CID 121234002
sodium;3,4-diaminobutanoic acid;hydride
CID 173483530
3-aminodocosanedioic acid
CID 57269564
3-amino-12-hydroxydodecanoic acid
CID 146253643
acetic acid;3,4-diaminobutanoic acid
CID 173099381
3-aminononanoic acid
CID 2832746
(3R)-3-amino-5-methylselanylpentanoic acid
CID 122173769
sodium;3-aminohenicosanoic acid;hydride
CID 175144455
7-aminonon-3-enedioic acid
CID 175407467

Frequently Asked Questions

What is the IUPAC name of azane;3,5-diaminopentanoic acid?
The IUPAC name of azane;3,5-diaminopentanoic acid (CID 173202896) is azane;3,5-diaminopentanoic acid.
What is the SMILES notation for azane;3,5-diaminopentanoic acid?
The canonical SMILES for azane;3,5-diaminopentanoic acid is N.NCCC(N)CC(=O)O.
What is the InChIKey of azane;3,5-diaminopentanoic acid?
The InChIKey is UKULVBRUBNYSEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O2.H3N/c6-2-1-4(7)3-5(8)9;/h4H,1-3,6-7H2,(H,8,9);1H3.
What are the key properties of azane;3,5-diaminopentanoic acid?
azane;3,5-diaminopentanoic acid has a molecular weight of 149.19 g/mol, XLogP of -0.70, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;3,5-diaminopentanoic acid is sourced from PubChem (CID 173202896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).