12-hydrazinyldodecanamide;methanimine

C13H30N4O — CID 177324846

IUPAC12-hydrazinyldodecanamide;methanimine
SMILESNNCCCCCCCCCCCC(N)=O.[H]N=C
InChIInChI=1S/C12H27N3O.CH3N/c13-12(16)10-8-6-4-2-1-3-5-7-9-11-15-14;1-2/h15H,1-11,14H2,(H2,13,16);2H,1H2
InChIKeyPUKWXZYQFKDJCM-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.10
Rot. Bonds12

About 12-hydrazinyldodecanamide;methanimine

12-hydrazinyldodecanamide;methanimine (PubChem CID 177324846) has the molecular formula C13H30N4O and a molecular weight of 258.41 g/mol. Its IUPAC name is 12-hydrazinyldodecanamide;methanimine.

Molecular Properties

Compound Name12-hydrazinyldodecanamide;methanimine
PubChem CID177324846
Molecular FormulaC13H30N4O
Molecular Weight258.41 g/mol
Exact Mass258.24
IUPAC Name12-hydrazinyldodecanamide;methanimine
SMILESNNCCCCCCCCCCCC(N)=O.[H]N=C
InChIInChI=1S/C12H27N3O.CH3N/c13-12(16)10-8-6-4-2-1-3-5-7-9-11-15-14;1-2/h15H,1-11,14H2,(H2,13,16);2H,1H2
InChIKeyPUKWXZYQFKDJCM-UHFFFAOYSA-N
XLogP2.10
TPSA104.99 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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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Related Compounds

7-hydrazinylheptanamide
CID 22099097
docosanediamide;hexacosanediamide
CID 129179979
dodecanediamide;nonanediamide
CID 175017820
pentadecanediamide
CID 87429217
nonatetracontanediamide
CID 162734608
6-(hydroxyamino)hexanamide
CID 167194445
5-hydrazinylpentanoic acid
CID 175506840
copper;tridecanediamide
CID 159780260
12-hydrazinyldodecylhydrazine
CID 19877691
6-(diaminomethylamino)hexanamide
CID 135228414
hexanediamide;hydrazine
CID 160978463
hexanediamide;hydrazine
CID 160854105

Frequently Asked Questions

What is the IUPAC name of 12-hydrazinyldodecanamide;methanimine?
The IUPAC name of 12-hydrazinyldodecanamide;methanimine (CID 177324846) is 12-hydrazinyldodecanamide;methanimine.
What is the SMILES notation for 12-hydrazinyldodecanamide;methanimine?
The canonical SMILES for 12-hydrazinyldodecanamide;methanimine is NNCCCCCCCCCCCC(N)=O.[H]N=C.
What is the InChIKey of 12-hydrazinyldodecanamide;methanimine?
The InChIKey is PUKWXZYQFKDJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O.CH3N/c13-12(16)10-8-6-4-2-1-3-5-7-9-11-15-14;1-2/h15H,1-11,14H2,(H2,13,16);2H,1H2.
What are the key properties of 12-hydrazinyldodecanamide;methanimine?
12-hydrazinyldodecanamide;methanimine has a molecular weight of 258.41 g/mol, XLogP of 2.10, 12 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 12-hydrazinyldodecanamide;methanimine is sourced from PubChem (CID 177324846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).