2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)

C6H14N4O2Ru+2 — CID 23025269

IUPAC2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)
SMILESNC(N)=NCCCC(N)C(=O)O.[Ru+2]
InChIInChI=1S/C6H14N4O2.Ru/c7-4(5(11)12)2-1-3-10-6(8)9;/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);/q;+2
InChIKeyMBTALRWDPXYNGR-UHFFFAOYSA-N
MW275.27 g/mol
LogP-1.55
Rot. Bonds5

About 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)

2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+) (PubChem CID 23025269) has the molecular formula C6H14N4O2Ru+2 and a molecular weight of 275.27 g/mol. Its IUPAC name is 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+).

Molecular Properties

Compound Name2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)
PubChem CID23025269
Molecular FormulaC6H14N4O2Ru+2
Molecular Weight275.27 g/mol
Exact Mass276.01
IUPAC Name2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)
SMILESNC(N)=NCCCC(N)C(=O)O.[Ru+2]
InChIInChI=1S/C6H14N4O2.Ru/c7-4(5(11)12)2-1-3-10-6(8)9;/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);/q;+2
InChIKeyMBTALRWDPXYNGR-UHFFFAOYSA-N
XLogP-1.55
TPSA127.72 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 5-1.55
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

potassium 2-amino-5-(diaminomethylideneamino)pentanoic acid
CID 22005786
2-amino-5-(diaminomethylideneamino)pentanoic acid;carbonic acid
CID 10198591
(2S)-2-amino-5-(diaminomethylideneamino)pentanoic acid;methane
CID 146220305
(2R)-2-amino-5-(diamino(113C)methylideneamino)(1,2,3,4,5-13C5)pentanoic acid;hydrochloride
CID 135705200
2-amino-5-(diaminomethylideneamino)pentanoic acid;cerium
CID 86698939
bis(2-amino-5-(diaminomethylideneamino)pentanoic acid);zinc
CID 154941617
sodium;2-amino-5-(diaminomethylideneamino)pentanoic acid;chloride
CID 87252256
2-amino-5-(diaminomethylideneamino)pentanoic acid;azane;phosphane
CID 175416337
2-amino-5-(diaminomethylideneamino)pentanoic acid;ethane-1,2-diol
CID 155169115
calcium;2-amino-5-(diaminomethylideneamino)pentanoic acid;carbonic acid;hydride
CID 174862078
2-amino-5-(diaminomethylideneamino)pentanoic acid;formamide
CID 174953444
2-amino-5-(diaminomethylideneamino)pentanoic acid;2-aminopropanoic acid
CID 21226270

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)?
The IUPAC name of 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+) (CID 23025269) is 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+).
What is the SMILES notation for 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)?
The canonical SMILES for 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+) is NC(N)=NCCCC(N)C(=O)O.[Ru+2].
What is the InChIKey of 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)?
The InChIKey is MBTALRWDPXYNGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N4O2.Ru/c7-4(5(11)12)2-1-3-10-6(8)9;/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);/q;+2.
What are the key properties of 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+)?
2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+) has a molecular weight of 275.27 g/mol, XLogP of -1.55, 5 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(diaminomethylideneamino)pentanoic acid;ruthenium(2+) is sourced from PubChem (CID 23025269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).