2-(2,6-dimethylheptan-4-ylideneamino)guanidine

C10H22N4 — CID 115571090

IUPAC2-(2,6-dimethylheptan-4-ylideneamino)guanidine
SMILESCC(C)CC(CC(C)C)=NN=C(N)N
InChIInChI=1S/C10H22N4/c1-7(2)5-9(6-8(3)4)13-14-10(11)12/h7-8H,5-6H2,1-4H3,(H4,11,12,14)
InChIKeyRBWJXSKHLQLUAU-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.71
Rot. Bonds5

About 2-(2,6-dimethylheptan-4-ylideneamino)guanidine

2-(2,6-dimethylheptan-4-ylideneamino)guanidine (PubChem CID 115571090) has the molecular formula C10H22N4 and a molecular weight of 198.31 g/mol. Its IUPAC name is 2-(2,6-dimethylheptan-4-ylideneamino)guanidine.

Molecular Properties

Compound Name2-(2,6-dimethylheptan-4-ylideneamino)guanidine
PubChem CID115571090
Molecular FormulaC10H22N4
Molecular Weight198.31 g/mol
Exact Mass198.18
IUPAC Name2-(2,6-dimethylheptan-4-ylideneamino)guanidine
SMILESCC(C)CC(CC(C)C)=NN=C(N)N
InChIInChI=1S/C10H22N4/c1-7(2)5-9(6-8(3)4)13-14-10(11)12/h7-8H,5-6H2,1-4H3,(H4,11,12,14)
InChIKeyRBWJXSKHLQLUAU-UHFFFAOYSA-N
XLogP1.71
TPSA76.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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

Hydrazinecarboximidamide, 2-(2-methylcyclohexylidene)-, monohydrochloride
CID 9578644
2-[(4-Propylcyclohexylidene)amino]guanidine
CID 3890761
2-[(E)-(2-methylcyclohexylidene)amino]guanidine
CID 9578645
2,6-Dimethylheptan-4-imine
CID 333868
diamino[(2E)-2-(1-cyclododecylethylidene)hydrazinyl]methylium
CID 9594038
2-(4-Methylpentan-2-ylideneamino)guanidine
CID 4034856
2-[(Z)-(2-methylcyclohexylidene)amino]guanidine
CID 5493421
2,6-Dimethylheptan-4-ylidenehydrazine
CID 22637305
2-[(E)-(2-heptylcyclopentylidene)amino]guanidine
CID 24859394
2,7-Dimethyloctane-4,5-diimine
CID 53784675
2,11-Dimethyldodecane-4,9-diimine
CID 57239756
2-[(E)-2-methylpentan-3-ylideneamino]guanidine
CID 57547719

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylheptan-4-ylideneamino)guanidine?
The IUPAC name of 2-(2,6-dimethylheptan-4-ylideneamino)guanidine (CID 115571090) is 2-(2,6-dimethylheptan-4-ylideneamino)guanidine.
What is the SMILES notation for 2-(2,6-dimethylheptan-4-ylideneamino)guanidine?
The canonical SMILES for 2-(2,6-dimethylheptan-4-ylideneamino)guanidine is CC(C)CC(CC(C)C)=NN=C(N)N.
What is the InChIKey of 2-(2,6-dimethylheptan-4-ylideneamino)guanidine?
The InChIKey is RBWJXSKHLQLUAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4/c1-7(2)5-9(6-8(3)4)13-14-10(11)12/h7-8H,5-6H2,1-4H3,(H4,11,12,14).
What are the key properties of 2-(2,6-dimethylheptan-4-ylideneamino)guanidine?
2-(2,6-dimethylheptan-4-ylideneamino)guanidine has a molecular weight of 198.31 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylheptan-4-ylideneamino)guanidine is sourced from PubChem (CID 115571090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).