[2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine

C16H26N2O — CID 114342332

IUPAC[2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine
SMILESCCc1cc(CN)cc(OC2CCC(C)(C)CC2)n1
InChIInChI=1S/C16H26N2O/c1-4-13-9-12(11-17)10-15(18-13)19-14-5-7-16(2,3)8-6-14/h9-10,14H,4-8,11,17H2,1-3H3
InChIKeyCADYBHMPSGWQEL-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.45
Rot. Bonds4

About [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine

[2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine (PubChem CID 114342332) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine.

Molecular Properties

Compound Name[2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine
PubChem CID114342332
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name[2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine
SMILESCCc1cc(CN)cc(OC2CCC(C)(C)CC2)n1
InChIInChI=1S/C16H26N2O/c1-4-13-9-12(11-17)10-15(18-13)19-14-5-7-16(2,3)8-6-14/h9-10,14H,4-8,11,17H2,1-3H3
InChIKeyCADYBHMPSGWQEL-UHFFFAOYSA-N
XLogP3.45
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(4,4-dimethylcyclohexyl)oxy-6-propyl-4-pyridinyl]methanamine
CID 114342269
(2,6-diethyl-4-pyridinyl)methanamine
CID 139559204
N-[[2-(4,4-dimethylcyclohexyl)oxy-4-pyridinyl]methyl]propan-1-amine
CID 114342312
N-[[6-(4,4-dimethylcyclohexyl)oxy-2-pyridinyl]methyl]-2-methylpropan-2-amine
CID 114342313
N-[[6-(4,4-dimethylcyclohexyl)oxypyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 114342320
[2-(oxetan-3-yloxy)-6-propan-2-yl-4-pyridinyl]methanamine
CID 102607865
2-(4,4-dimethylcyclohexyl)oxy-6-methylpyridine-4-carbothioamide
CID 114768254
ethane;4-ethyl-2-methyl-6-(4-methylcyclohexyl)oxypyrimidine
CID 176690931
4-bromo-2-tert-butyl-6-(4,4-dimethylcyclohexyl)oxypyrimidine
CID 114340982
[2-(4-bromo-3,5-dimethylphenoxy)-6-ethyl-4-pyridinyl]methanamine
CID 107725807
5-bromo-2-(4,4-dimethylcyclohexyl)oxy-4-methylpyridine
CID 114870816
[4-(4,4-dimethylcyclohexyl)oxy-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 114567840

Frequently Asked Questions

What is the IUPAC name of [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine?
The IUPAC name of [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine (CID 114342332) is [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine.
What is the SMILES notation for [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine?
The canonical SMILES for [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine is CCc1cc(CN)cc(OC2CCC(C)(C)CC2)n1.
What is the InChIKey of [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine?
The InChIKey is CADYBHMPSGWQEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-13-9-12(11-17)10-15(18-13)19-14-5-7-16(2,3)8-6-14/h9-10,14H,4-8,11,17H2,1-3H3.
What are the key properties of [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine?
[2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine has a molecular weight of 262.40 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4,4-dimethylcyclohexyl)oxy-6-ethyl-4-pyridinyl]methanamine is sourced from PubChem (CID 114342332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).