N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine

C16H26N2O2 — CID 43782133

IUPACN-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine
SMILESCOCCOc1ccc(NC(C)C2CCCCC2)cn1
InChIInChI=1S/C16H26N2O2/c1-13(14-6-4-3-5-7-14)18-15-8-9-16(17-12-15)20-11-10-19-2/h8-9,12-14,18H,3-7,10-11H2,1-2H3
InChIKeyGLZMYLHYKZLGPO-UHFFFAOYSA-N
MW278.40 g/mol
LogP3.49
Rot. Bonds7

About N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine

N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine (PubChem CID 43782133) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine
PubChem CID43782133
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC NameN-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine
SMILESCOCCOc1ccc(NC(C)C2CCCCC2)cn1
InChIInChI=1S/C16H26N2O2/c1-13(14-6-4-3-5-7-14)18-15-8-9-16(17-12-15)20-11-10-19-2/h8-9,12-14,18H,3-7,10-11H2,1-2H3
InChIKeyGLZMYLHYKZLGPO-UHFFFAOYSA-N
XLogP3.49
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine?
The IUPAC name of N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine (CID 43782133) is N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine.
What is the SMILES notation for N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine?
The canonical SMILES for N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine is COCCOc1ccc(NC(C)C2CCCCC2)cn1.
What is the InChIKey of N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine?
The InChIKey is GLZMYLHYKZLGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-13(14-6-4-3-5-7-14)18-15-8-9-16(17-12-15)20-11-10-19-2/h8-9,12-14,18H,3-7,10-11H2,1-2H3.
What are the key properties of N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine?
N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine has a molecular weight of 278.40 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-6-(2-methoxyethoxy)pyridin-3-amine is sourced from PubChem (CID 43782133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).