N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide

C13H26N2 — CID 65402208

IUPACN'-propan-2-yl-4-propylcyclohexane-1-carboximidamide
SMILESCCCC1CCC(/C(N)=N/C(C)C)CC1
InChIInChI=1S/C13H26N2/c1-4-5-11-6-8-12(9-7-11)13(14)15-10(2)3/h10-12H,4-9H2,1-3H3,(H2,14,15)
InChIKeyUXQFGNVUOAIOJG-UHFFFAOYSA-N
MW210.37 g/mol
LogP3.36
Rot. Bonds4

About N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide

N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide (PubChem CID 65402208) has the molecular formula C13H26N2 and a molecular weight of 210.37 g/mol. Its IUPAC name is N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide.

Molecular Properties

Compound NameN'-propan-2-yl-4-propylcyclohexane-1-carboximidamide
PubChem CID65402208
Molecular FormulaC13H26N2
Molecular Weight210.37 g/mol
Exact Mass210.21
IUPAC NameN'-propan-2-yl-4-propylcyclohexane-1-carboximidamide
SMILESCCCC1CCC(/C(N)=N/C(C)C)CC1
InChIInChI=1S/C13H26N2/c1-4-5-11-6-8-12(9-7-11)13(14)15-10(2)3/h10-12H,4-9H2,1-3H3,(H2,14,15)
InChIKeyUXQFGNVUOAIOJG-UHFFFAOYSA-N
XLogP3.36
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.37
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide?
The IUPAC name of N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide (CID 65402208) is N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide.
What is the SMILES notation for N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide?
The canonical SMILES for N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide is CCCC1CCC(/C(N)=N/C(C)C)CC1.
What is the InChIKey of N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide?
The InChIKey is UXQFGNVUOAIOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-4-5-11-6-8-12(9-7-11)13(14)15-10(2)3/h10-12H,4-9H2,1-3H3,(H2,14,15).
What are the key properties of N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide?
N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide has a molecular weight of 210.37 g/mol, XLogP of 3.36, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-propan-2-yl-4-propylcyclohexane-1-carboximidamide is sourced from PubChem (CID 65402208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).