5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide

C13H19N3O — CID 113321289

IUPAC5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(OC2CCC(C)CC2)cn1
InChIInChI=1S/C13H19N3O/c1-9-2-4-10(5-3-9)17-11-6-7-12(13(14)15)16-8-11/h6-10H,2-5H2,1H3,(H3,14,15)
InChIKeyHYMJKVUPKCHWQO-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.32
Rot. Bonds3

About 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide

5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide (PubChem CID 113321289) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide.

Molecular Properties

Compound Name5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide
PubChem CID113321289
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(OC2CCC(C)CC2)cn1
InChIInChI=1S/C13H19N3O/c1-9-2-4-10(5-3-9)17-11-6-7-12(13(14)15)16-8-11/h6-10H,2-5H2,1H3,(H3,14,15)
InChIKeyHYMJKVUPKCHWQO-UHFFFAOYSA-N
XLogP2.32
TPSA71.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide 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

Pozanicline
CID 178052
2-Amino-3-benzyloxypyridine
CID 90334
5-[5-[(6-Carbamimidoyl-3-pyridinyl)oxy]pentoxy]pyridine-2-carboximidamide
CID 44220277
US10155760, Example 125
CID 118429626
US10155760, Example 122
CID 118429629
(R)-2-Methyl-3-(2-pyrrolidinylmethoxy)pyridine
CID 127922
N-methyl-1-[(6-methyl-3-pyridinyl)oxymethyl]cyclopropan-1-amine;hydrochloride
CID 9899400
2-Methyl-3-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 10560219
3-[2-[1-(4,5-dihydro-1H-imidazol-2-yl)ethoxy]phenyl]pyridine
CID 11265631
2-Methyl-5-{[(2S)-1-methylpyrrolidin-2-yl]methoxy}pyridine
CID 44318904
5-[[(2S)-azetidin-2-yl]methoxy]-2-ethylpyridine
CID 44327374
Dimethyl-[2-(6-methyl-pyridin-3-yloxy)-ethyl]-amine
CID 44340957

Frequently Asked Questions

What is the IUPAC name of 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide?
The IUPAC name of 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide (CID 113321289) is 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide.
What is the SMILES notation for 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide?
The canonical SMILES for 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide is [H]/N=C(\N)c1ccc(OC2CCC(C)CC2)cn1.
What is the InChIKey of 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide?
The InChIKey is HYMJKVUPKCHWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-9-2-4-10(5-3-9)17-11-6-7-12(13(14)15)16-8-11/h6-10H,2-5H2,1H3,(H3,14,15).
What are the key properties of 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide?
5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide has a molecular weight of 233.31 g/mol, XLogP of 2.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylcyclohexyl)oxypyridine-2-carboximidamide is sourced from PubChem (CID 113321289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).