N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine

C15H24N2O2 — CID 55058614

IUPACN-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1c(C)cc(C)nc1OC1CCOCC1
InChIInChI=1S/C15H24N2O2/c1-4-16-10-14-11(2)9-12(3)17-15(14)19-13-5-7-18-8-6-13/h9,13,16H,4-8,10H2,1-3H3
InChIKeyYUVWNXJBPAZZKX-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.37
Rot. Bonds5

About N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine

N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine (PubChem CID 55058614) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine
PubChem CID55058614
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC NameN-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1c(C)cc(C)nc1OC1CCOCC1
InChIInChI=1S/C15H24N2O2/c1-4-16-10-14-11(2)9-12(3)17-15(14)19-13-5-7-18-8-6-13/h9,13,16H,4-8,10H2,1-3H3
InChIKeyYUVWNXJBPAZZKX-UHFFFAOYSA-N
XLogP2.37
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine (CID 55058614) is N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine is CCNCc1c(C)cc(C)nc1OC1CCOCC1.
What is the InChIKey of N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine?
The InChIKey is YUVWNXJBPAZZKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-4-16-10-14-11(2)9-12(3)17-15(14)19-13-5-7-18-8-6-13/h9,13,16H,4-8,10H2,1-3H3.
What are the key properties of N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine?
N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine has a molecular weight of 264.37 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4,6-dimethyl-2-(oxan-4-yloxy)-3-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 55058614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).