1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine

C15H24N2O — CID 64730643

IUPAC1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(OC2CC(C)CC(C)C2)n1
InChIInChI=1S/C15H24N2O/c1-11-7-12(2)9-14(8-11)18-15-6-4-5-13(17-15)10-16-3/h4-6,11-12,14,16H,7-10H2,1-3H3
InChIKeyVHAVDLJEQZWYKB-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.00
Rot. Bonds4

About 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine

1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine (PubChem CID 64730643) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine
PubChem CID64730643
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(OC2CC(C)CC(C)C2)n1
InChIInChI=1S/C15H24N2O/c1-11-7-12(2)9-14(8-11)18-15-6-4-5-13(17-15)10-16-3/h4-6,11-12,14,16H,7-10H2,1-3H3
InChIKeyVHAVDLJEQZWYKB-UHFFFAOYSA-N
XLogP3.00
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine (CID 64730643) is 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine is CNCc1cccc(OC2CC(C)CC(C)C2)n1.
What is the InChIKey of 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine?
The InChIKey is VHAVDLJEQZWYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-11-7-12(2)9-14(8-11)18-15-6-4-5-13(17-15)10-16-3/h4-6,11-12,14,16H,7-10H2,1-3H3.
What are the key properties of 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine?
1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine has a molecular weight of 248.37 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(3,5-dimethylcyclohexyl)oxy-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 64730643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).