1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine

C11H24N4 — CID 104886810

IUPAC1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine
SMILESCC/N=C(\NN)NC1CCCC(CC)C1
InChIInChI=1S/C11H24N4/c1-3-9-6-5-7-10(8-9)14-11(15-12)13-4-2/h9-10H,3-8,12H2,1-2H3,(H2,13,14,15)
InChIKeyILHWJIZOJOZBFG-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.38
Rot. Bonds3

About 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine

1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine (PubChem CID 104886810) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine.

Molecular Properties

Compound Name1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine
PubChem CID104886810
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC Name1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine
SMILESCC/N=C(\NN)NC1CCCC(CC)C1
InChIInChI=1S/C11H24N4/c1-3-9-6-5-7-10(8-9)14-11(15-12)13-4-2/h9-10H,3-8,12H2,1-2H3,(H2,13,14,15)
InChIKeyILHWJIZOJOZBFG-UHFFFAOYSA-N
XLogP1.38
TPSA62.44 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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

1-amino-3-(3-ethylcyclohexyl)-2-(2-methylpropyl)guanidine
CID 104886815
1-amino-2-ethyl-3-(4-propylcyclohexyl)guanidine
CID 104885055
1-amino-3-(1,2-dimethylpiperidin-4-yl)-2-ethylguanidine
CID 104887817
1-amino-3-cyclopentyl-2-(cyclopentylmethyl)guanidine
CID 104883783
2-cyclopentyl-1-(3-ethylcyclohexyl)guanidine
CID 64750200
1-ethyl-3-(3-ethylcyclohexyl)-2-[(1-hydroxycyclopentyl)methyl]guanidine
CID 111995647
1-amino-2-ethyl-3-(2-ethylcyclohexyl)guanidine
CID 104885309
cis-(1R,3S)-3-ethyl-N-methylcyclohexan-1-amine
CID 129149436
2-[[ethylamino-[(3-ethylcyclohexyl)amino]methylidene]amino]-N,N-dimethylacetamide
CID 110041706
1-amino-2-(2-cyclobutylethyl)-3-cyclopropylguanidine
CID 104888658
N-[2-[[N-(3-ethylcyclohexyl)-N'-methylcarbamimidoyl]amino]ethyl]-2,2-dimethylpropanamide
CID 111997485
3-amino-N-(3-ethylcyclohexyl)-3-methylbutanamide
CID 64747634

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine?
The IUPAC name of 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine (CID 104886810) is 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine.
What is the SMILES notation for 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine?
The canonical SMILES for 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine is CC/N=C(\NN)NC1CCCC(CC)C1.
What is the InChIKey of 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine?
The InChIKey is ILHWJIZOJOZBFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4/c1-3-9-6-5-7-10(8-9)14-11(15-12)13-4-2/h9-10H,3-8,12H2,1-2H3,(H2,13,14,15).
What are the key properties of 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine?
1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine has a molecular weight of 212.34 g/mol, XLogP of 1.38, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-ethyl-3-(3-ethylcyclohexyl)guanidine is sourced from PubChem (CID 104886810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).