(2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide

C5H10N4O — CID 168913138

IUPAC(2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide
SMILESC/N=C/C(=N\N)C(=O)NC
InChIInChI=1S/C5H10N4O/c1-7-3-4(9-6)5(10)8-2/h3H,6H2,1-2H3,(H,8,10)/b7-3+,9-4+
InChIKeyBGNAGRHEOOLNCN-DDEWIXKASA-N
MW142.16 g/mol
LogP-1.25
Rot. Bonds2

About (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide

(2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide (PubChem CID 168913138) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide.

Molecular Properties

Compound Name(2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide
PubChem CID168913138
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name(2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide
SMILESC/N=C/C(=N\N)C(=O)NC
InChIInChI=1S/C5H10N4O/c1-7-3-4(9-6)5(10)8-2/h3H,6H2,1-2H3,(H,8,10)/b7-3+,9-4+
InChIKeyBGNAGRHEOOLNCN-DDEWIXKASA-N
XLogP-1.25
TPSA79.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide?
The IUPAC name of (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide (CID 168913138) is (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide.
What is the SMILES notation for (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide?
The canonical SMILES for (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide is C/N=C/C(=N\N)C(=O)NC.
What is the InChIKey of (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide?
The InChIKey is BGNAGRHEOOLNCN-DDEWIXKASA-N. The full InChI is InChI=1S/C5H10N4O/c1-7-3-4(9-6)5(10)8-2/h3H,6H2,1-2H3,(H,8,10)/b7-3+,9-4+.
What are the key properties of (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide?
(2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide has a molecular weight of 142.16 g/mol, XLogP of -1.25, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-hydrazinylidene-N-methyl-3-methyliminopropanamide is sourced from PubChem (CID 168913138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).