N-amino-3-cyclohexyl-N'-ethylpropanimidamide

C11H23N3 — CID 61363441

IUPACN-amino-3-cyclohexyl-N'-ethylpropanimidamide
SMILESCC/N=C(/CCC1CCCCC1)NN
InChIInChI=1S/C11H23N3/c1-2-13-11(14-12)9-8-10-6-4-3-5-7-10/h10H,2-9,12H2,1H3,(H,13,14)
InChIKeyGABIKCBXJVEOMH-UHFFFAOYSA-N
MW197.33 g/mol
LogP2.23
Rot. Bonds4

About N-amino-3-cyclohexyl-N'-ethylpropanimidamide

N-amino-3-cyclohexyl-N'-ethylpropanimidamide (PubChem CID 61363441) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N-amino-3-cyclohexyl-N'-ethylpropanimidamide.

Molecular Properties

Compound NameN-amino-3-cyclohexyl-N'-ethylpropanimidamide
PubChem CID61363441
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN-amino-3-cyclohexyl-N'-ethylpropanimidamide
SMILESCC/N=C(/CCC1CCCCC1)NN
InChIInChI=1S/C11H23N3/c1-2-13-11(14-12)9-8-10-6-4-3-5-7-10/h10H,2-9,12H2,1H3,(H,13,14)
InChIKeyGABIKCBXJVEOMH-UHFFFAOYSA-N
XLogP2.23
TPSA50.41 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
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-3-cyclopentyl-N'-propylpropanimidamide
CID 61360667
N-amino-N'-tert-butyl-3-cyclopentylpropanimidamide
CID 61361099
N-amino-3-cyclopentyl-N'-propan-2-ylpropanimidamide
CID 61362883
N-amino-N'-ethylcyclooctanecarboximidamide
CID 65020858
propylcyclotetradecane
CID 90991550
N-amino-N'-cyclohexylpropanimidamide
CID 61363512
1-amino-2-ethyl-3-(4-propylcyclohexyl)guanidine
CID 104885055
1-amino-2-ethyl-3-(2-ethylcyclohexyl)guanidine
CID 104885309
N-amino-2-cycloheptyl-N'-cyclopropylethanimidamide
CID 104928915
N-amino-N'-cycloheptyl-2-cyclohexylethanimidamide
CID 63462480
3-cycloheptyl-N-ethylpropanethioamide
CID 144615502
1-(2-cyclohexylethyl)-4-[2-(4-propylcyclohexyl)ethyl]cyclohexane
CID 70430254

Frequently Asked Questions

What is the IUPAC name of N-amino-3-cyclohexyl-N'-ethylpropanimidamide?
The IUPAC name of N-amino-3-cyclohexyl-N'-ethylpropanimidamide (CID 61363441) is N-amino-3-cyclohexyl-N'-ethylpropanimidamide.
What is the SMILES notation for N-amino-3-cyclohexyl-N'-ethylpropanimidamide?
The canonical SMILES for N-amino-3-cyclohexyl-N'-ethylpropanimidamide is CC/N=C(/CCC1CCCCC1)NN.
What is the InChIKey of N-amino-3-cyclohexyl-N'-ethylpropanimidamide?
The InChIKey is GABIKCBXJVEOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-2-13-11(14-12)9-8-10-6-4-3-5-7-10/h10H,2-9,12H2,1H3,(H,13,14).
What are the key properties of N-amino-3-cyclohexyl-N'-ethylpropanimidamide?
N-amino-3-cyclohexyl-N'-ethylpropanimidamide has a molecular weight of 197.33 g/mol, XLogP of 2.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-amino-3-cyclohexyl-N'-ethylpropanimidamide is sourced from PubChem (CID 61363441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).