N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide

C14H21N3 — CID 55160157

IUPACN'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide
SMILESCC(/N=C(\N)C1CCCCC1)c1ccncc1
InChIInChI=1S/C14H21N3/c1-11(12-7-9-16-10-8-12)17-14(15)13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H2,15,17)
InChIKeyGGLDNMQCJNGCTB-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.08
Rot. Bonds3

About N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide

N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide (PubChem CID 55160157) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide.

Molecular Properties

Compound NameN'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide
PubChem CID55160157
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC NameN'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide
SMILESCC(/N=C(\N)C1CCCCC1)c1ccncc1
InChIInChI=1S/C14H21N3/c1-11(12-7-9-16-10-8-12)17-14(15)13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H2,15,17)
InChIKeyGGLDNMQCJNGCTB-UHFFFAOYSA-N
XLogP3.08
TPSA51.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide with MolForge

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

Launch Full Analysis

Related Compounds

Nicotine
CID 89594
Ethionamide
CID 2761171
Anabasine
CID 205586
Nornicotine
CID 91462
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
Pheniramine
CID 4761
3-(Pyrrolidin-2-yl)pyridine
CID 412
(+-)-Anabasine
CID 2181
2-Amino-4-methylpyridine
CID 1533
Myosmine
CID 442649
5-Ethyl-2-methylpyridine
CID 7728
Anabaseine
CID 18985

Frequently Asked Questions

What is the IUPAC name of N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide?
The IUPAC name of N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide (CID 55160157) is N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide.
What is the SMILES notation for N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide?
The canonical SMILES for N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide is CC(/N=C(\N)C1CCCCC1)c1ccncc1.
What is the InChIKey of N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide?
The InChIKey is GGLDNMQCJNGCTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c1-11(12-7-9-16-10-8-12)17-14(15)13-5-3-2-4-6-13/h7-11,13H,2-6H2,1H3,(H2,15,17).
What are the key properties of N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide?
N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide has a molecular weight of 231.34 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-pyridin-4-ylethyl)cyclohexanecarboximidamide is sourced from PubChem (CID 55160157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).