[(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea

C8H20N6O — CID 143471674

IUPAC[(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea
SMILESCN(N)/N=C(\N)CCCCCNC(N)=O
InChIInChI=1S/C8H20N6O/c1-14(11)13-7(9)5-3-2-4-6-12-8(10)15/h2-6,11H2,1H3,(H2,9,13)(H3,10,12,15)
InChIKeyLUHOHIGURHOGEB-UHFFFAOYSA-N
MW216.29 g/mol
LogP-0.71
Rot. Bonds7

About [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea

[(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea (PubChem CID 143471674) has the molecular formula C8H20N6O and a molecular weight of 216.29 g/mol. Its IUPAC name is [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea.

Molecular Properties

Compound Name[(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea
PubChem CID143471674
Molecular FormulaC8H20N6O
Molecular Weight216.29 g/mol
Exact Mass216.17
IUPAC Name[(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea
SMILESCN(N)/N=C(\N)CCCCCNC(N)=O
InChIInChI=1S/C8H20N6O/c1-14(11)13-7(9)5-3-2-4-6-12-8(10)15/h2-6,11H2,1H3,(H2,9,13)(H3,10,12,15)
InChIKeyLUHOHIGURHOGEB-UHFFFAOYSA-N
XLogP-0.71
TPSA122.76 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 5-0.71
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': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N'-[amino(methyl)amino]pentanimidamide
CID 144800598
5-(carbamoylamino)pentanamide;hydrochloride
CID 175794567
12-hydroxydodecylurea
CID 57265418
pentylurea;hydrate
CID 172845599
N-(5-amino-5-hydroxyiminopentyl)octanamide
CID 77036923
2-(dimethylamino)ethylurea
CID 16785331
1-[8-(carbamoylamino)octyl]-3-methylurea
CID 129172713
11-(propanoylamino)undecanamide
CID 89244012
butylurea;silicic acid
CID 86735760
6-trimethoxysilylhexylurea
CID 87148927
6-(octylcarbamoylamino)hexanamide
CID 11833003
N-[4-(dimethylamino)butyl]docosanamide
CID 87265167

Frequently Asked Questions

What is the IUPAC name of [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea?
The IUPAC name of [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea (CID 143471674) is [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea.
What is the SMILES notation for [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea?
The canonical SMILES for [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea is CN(N)/N=C(\N)CCCCCNC(N)=O.
What is the InChIKey of [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea?
The InChIKey is LUHOHIGURHOGEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N6O/c1-14(11)13-7(9)5-3-2-4-6-12-8(10)15/h2-6,11H2,1H3,(H2,9,13)(H3,10,12,15).
What are the key properties of [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea?
[(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea has a molecular weight of 216.29 g/mol, XLogP of -0.71, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(6Z)-6-amino-6-[amino(methyl)hydrazinylidene]hexyl]urea is sourced from PubChem (CID 143471674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).