1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine

C16H28N2O — CID 115843940

IUPAC1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine
SMILESCCC(C)(C)C(Cc1ncc(C)c(OC)c1C)NC
InChIInChI=1S/C16H28N2O/c1-8-16(4,5)14(17-6)9-13-12(3)15(19-7)11(2)10-18-13/h10,14,17H,8-9H2,1-7H3
InChIKeyZAHDOGSAFSKNKF-UHFFFAOYSA-N
MW264.41 g/mol
LogP3.27
Rot. Bonds6

About 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine

1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine (PubChem CID 115843940) has the molecular formula C16H28N2O and a molecular weight of 264.41 g/mol. Its IUPAC name is 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine.

Molecular Properties

Compound Name1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine
PubChem CID115843940
Molecular FormulaC16H28N2O
Molecular Weight264.41 g/mol
Exact Mass264.22
IUPAC Name1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine
SMILESCCC(C)(C)C(Cc1ncc(C)c(OC)c1C)NC
InChIInChI=1S/C16H28N2O/c1-8-16(4,5)14(17-6)9-13-12(3)15(19-7)11(2)10-18-13/h10,14,17H,8-9H2,1-7H3
InChIKeyZAHDOGSAFSKNKF-UHFFFAOYSA-N
XLogP3.27
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine?
The IUPAC name of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine (CID 115843940) is 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine.
What is the SMILES notation for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine?
The canonical SMILES for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine is CCC(C)(C)C(Cc1ncc(C)c(OC)c1C)NC.
What is the InChIKey of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine?
The InChIKey is ZAHDOGSAFSKNKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O/c1-8-16(4,5)14(17-6)9-13-12(3)15(19-7)11(2)10-18-13/h10,14,17H,8-9H2,1-7H3.
What are the key properties of 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine?
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine has a molecular weight of 264.41 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N,3,3-trimethylpentan-2-amine is sourced from PubChem (CID 115843940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).