2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide

C4H10N6O — CID 83032126

IUPAC2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide
SMILESNC(=O)C/N=C(\N)N=C(N)N
InChIInChI=1S/C4H10N6O/c5-2(11)1-9-4(8)10-3(6)7/h1H2,(H2,5,11)(H6,6,7,8,9,10)
InChIKeyOGFZAFMTZKSWIL-UHFFFAOYSA-N
MW158.17 g/mol
LogP-2.94
Rot. Bonds2

About 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide

2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide (PubChem CID 83032126) has the molecular formula C4H10N6O and a molecular weight of 158.17 g/mol. Its IUPAC name is 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide.

Molecular Properties

Compound Name2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide
PubChem CID83032126
Molecular FormulaC4H10N6O
Molecular Weight158.17 g/mol
Exact Mass158.09
IUPAC Name2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide
SMILESNC(=O)C/N=C(\N)N=C(N)N
InChIInChI=1S/C4H10N6O/c5-2(11)1-9-4(8)10-3(6)7/h1H2,(H2,5,11)(H6,6,7,8,9,10)
InChIKeyOGFZAFMTZKSWIL-UHFFFAOYSA-N
XLogP-2.94
TPSA145.87 Ų
H-Bond Donors4
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.17
LogP ≤ 5-2.94
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide?
The IUPAC name of 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide (CID 83032126) is 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide.
What is the SMILES notation for 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide?
The canonical SMILES for 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide is NC(=O)C/N=C(\N)N=C(N)N.
What is the InChIKey of 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide?
The InChIKey is OGFZAFMTZKSWIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N6O/c5-2(11)1-9-4(8)10-3(6)7/h1H2,(H2,5,11)(H6,6,7,8,9,10).
What are the key properties of 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide?
2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide has a molecular weight of 158.17 g/mol, XLogP of -2.94, 2 rotatable bonds, 4 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino-(diaminomethylideneamino)methylidene]amino]acetamide is sourced from PubChem (CID 83032126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).