2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine

C16H26N2O — CID 116771590

IUPAC2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCNC(c1cncc(C)c1)C(OC)C1CCCCC1
InChIInChI=1S/C16H26N2O/c1-12-9-14(11-18-10-12)15(17-2)16(19-3)13-7-5-4-6-8-13/h9-11,13,15-17H,4-8H2,1-3H3
InChIKeyRRHVUHXAGPNRQI-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.25
Rot. Bonds5

About 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine

2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine (PubChem CID 116771590) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
PubChem CID116771590
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCNC(c1cncc(C)c1)C(OC)C1CCCCC1
InChIInChI=1S/C16H26N2O/c1-12-9-14(11-18-10-12)15(17-2)16(19-3)13-7-5-4-6-8-13/h9-11,13,15-17H,4-8H2,1-3H3
InChIKeyRRHVUHXAGPNRQI-UHFFFAOYSA-N
XLogP3.25
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-cyclopropyl-2-methoxy-1-(5-methyl-3-pyridinyl)ethyl]hydrazine
CID 105272724
2-cyclohexyl-1-(3-fluoro-5-methylphenyl)-2-methoxy-N-methylethanamine
CID 116771626
2-cyclohexyl-1-(3,4-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771600
2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)propan-1-amine
CID 115374857
2-cyclohexyl-2-methoxy-N-methyl-1-(2,4,5-trimethylphenyl)ethanamine
CID 116771562
[cyclopentyl-(5-methyl-3-pyridinyl)methyl]hydrazine
CID 105204323
2-cyclohexyl-2-methoxy-1-(4-methoxy-2-methylphenyl)-N-methylethanamine
CID 116771624
2-cyclohexyl-1-(4-fluoro-2-methylphenyl)-2-methoxy-N-methylethanamine
CID 116771486
N,2,3-trimethyl-1-(5-methyl-3-pyridinyl)butan-1-amine
CID 105022959
2-cyclopropyl-N-ethyl-1-(5-methyl-3-pyridinyl)propan-1-amine
CID 105022949
2-cyclohexyl-1-(2,3-dimethylphenyl)-2-methoxy-N-methylethanamine
CID 116771448
2-cyclohexyl-1-(5-methyl-3-pyridinyl)ethanol
CID 115373791

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine (CID 116771590) is 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine is CNC(c1cncc(C)c1)C(OC)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
The InChIKey is RRHVUHXAGPNRQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12-9-14(11-18-10-12)15(17-2)16(19-3)13-7-5-4-6-8-13/h9-11,13,15-17H,4-8H2,1-3H3.
What are the key properties of 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine?
2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine has a molecular weight of 262.40 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-2-methoxy-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 116771590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).