(5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine

C14H22N2O — CID 106830483

IUPAC(5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine
SMILESCOc1cncc(C(N)C2(C)CCCCC2)c1
InChIInChI=1S/C14H22N2O/c1-14(6-4-3-5-7-14)13(15)11-8-12(17-2)10-16-9-11/h8-10,13H,3-7,15H2,1-2H3
InChIKeyWKTOMMLQXUKIDW-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.06
Rot. Bonds3

About (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine

(5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine (PubChem CID 106830483) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine.

Molecular Properties

Compound Name(5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine
PubChem CID106830483
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name(5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine
SMILESCOc1cncc(C(N)C2(C)CCCCC2)c1
InChIInChI=1S/C14H22N2O/c1-14(6-4-3-5-7-14)13(15)11-8-12(17-2)10-16-9-11/h8-10,13H,3-7,15H2,1-2H3
InChIKeyWKTOMMLQXUKIDW-UHFFFAOYSA-N
XLogP3.06
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine 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

(1-methylcyclohexyl)-(5-methyl-3-pyridinyl)methanamine
CID 106830463
(1-methylcyclopentyl)-(5-methyl-3-pyridinyl)methanamine
CID 105022796
(1-ethoxycycloheptyl)-(5-methoxy-3-pyridinyl)methanamine
CID 116770623
(1-methoxy-4,4-dimethylcyclohexyl)-(5-methoxy-3-pyridinyl)methanamine
CID 116769046
(3,5-dimethoxyphenyl)-(1-methylcyclohexyl)methanol
CID 106830959
[(1-methylcyclopentyl)-(5-propan-2-yloxy-3-pyridinyl)methyl]hydrazine
CID 105330488
3-(dimethoxymethyl)-5-methoxypyridine
CID 45361740
[cyclooctyl-(5-methoxy-3-pyridinyl)methyl]hydrazine
CID 105255257
(3,5-dimethoxyphenyl)-(1-methoxycyclopentyl)methanamine
CID 104610743
1-(5-methoxy-3-pyridinyl)-2,2-dimethylbutan-1-amine
CID 105026104
2-ethoxy-1-(5-methoxy-3-pyridinyl)-2-methylbutan-1-amine
CID 116758508
(3,4-dimethylphenyl)-(5-methoxy-3-pyridinyl)methanamine
CID 105025843

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine?
The IUPAC name of (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine (CID 106830483) is (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine.
What is the SMILES notation for (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine?
The canonical SMILES for (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine is COc1cncc(C(N)C2(C)CCCCC2)c1.
What is the InChIKey of (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine?
The InChIKey is WKTOMMLQXUKIDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-14(6-4-3-5-7-14)13(15)11-8-12(17-2)10-16-9-11/h8-10,13H,3-7,15H2,1-2H3.
What are the key properties of (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine?
(5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine has a molecular weight of 234.34 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-3-pyridinyl)-(1-methylcyclohexyl)methanamine is sourced from PubChem (CID 106830483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).