N-amino-N'-ethylcyclooctanecarboximidamide

C11H23N3 — CID 65020858

IUPACN-amino-N'-ethylcyclooctanecarboximidamide
SMILESCC/N=C(\NN)C1CCCCCCC1
InChIInChI=1S/C11H23N3/c1-2-13-11(14-12)10-8-6-4-3-5-7-9-10/h10H,2-9,12H2,1H3,(H,13,14)
InChIKeyJNLZNZJQDVGFFB-UHFFFAOYSA-N
MW197.33 g/mol
LogP2.23
Rot. Bonds2

About N-amino-N'-ethylcyclooctanecarboximidamide

N-amino-N'-ethylcyclooctanecarboximidamide (PubChem CID 65020858) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N-amino-N'-ethylcyclooctanecarboximidamide.

Molecular Properties

Compound NameN-amino-N'-ethylcyclooctanecarboximidamide
PubChem CID65020858
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN-amino-N'-ethylcyclooctanecarboximidamide
SMILESCC/N=C(\NN)C1CCCCCCC1
InChIInChI=1S/C11H23N3/c1-2-13-11(14-12)10-8-6-4-3-5-7-9-10/h10H,2-9,12H2,1H3,(H,13,14)
InChIKeyJNLZNZJQDVGFFB-UHFFFAOYSA-N
XLogP2.23
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 52.23
H-Bond Donors ≤ 52
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

N-amino-N'-tert-butylcycloheptanecarboximidamide
CID 62590760
N-amino-N'-cycloheptylcycloheptanecarboximidamide
CID 55194306
N-amino-N'-ethyl-5-methyloxolane-3-carboximidamide
CID 104979367
N-amino-N'-cyclopropylcyclopentanecarboximidamide
CID 61362316
N-amino-3-cyclohexyl-N'-ethylpropanimidamide
CID 61363441
1-cyclohexyl-2-ethylguanidine
CID 18727697
1-amino-3-(1-cyclohexylpropyl)-2-ethylguanidine
CID 104884009
(E)-4-cyclohexyl-N-ethylpent-3-en-2-imine
CID 142125943
N-amino-N'-cyclohexylpropanimidamide
CID 61363512
N-amino-N'-cycloheptyloxane-3-carboximidamide
CID 63015816
1-amino-2-ethyl-3-(2-ethylcyclohexyl)guanidine
CID 104885309
N-amino-N'-ethyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboximidamide
CID 104887396

Frequently Asked Questions

What is the IUPAC name of N-amino-N'-ethylcyclooctanecarboximidamide?
The IUPAC name of N-amino-N'-ethylcyclooctanecarboximidamide (CID 65020858) is N-amino-N'-ethylcyclooctanecarboximidamide.
What is the SMILES notation for N-amino-N'-ethylcyclooctanecarboximidamide?
The canonical SMILES for N-amino-N'-ethylcyclooctanecarboximidamide is CC/N=C(\NN)C1CCCCCCC1.
What is the InChIKey of N-amino-N'-ethylcyclooctanecarboximidamide?
The InChIKey is JNLZNZJQDVGFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-2-13-11(14-12)10-8-6-4-3-5-7-9-10/h10H,2-9,12H2,1H3,(H,13,14).
What are the key properties of N-amino-N'-ethylcyclooctanecarboximidamide?
N-amino-N'-ethylcyclooctanecarboximidamide has a molecular weight of 197.33 g/mol, XLogP of 2.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-N'-ethylcyclooctanecarboximidamide is sourced from PubChem (CID 65020858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).