6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

C16H27N3O2 — CID 63972677

IUPAC6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCOCC1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1
InChIInChI=1S/C16H27N3O2/c1-16(2,3)21-15-13(17)5-6-14(18-15)19-9-7-12(8-10-19)11-20-4/h5-6,12H,7-11,17H2,1-4H3
InChIKeySFOQTXSUFBGRNG-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.70
Rot. Bonds4

About 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 63972677) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID63972677
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCOCC1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1
InChIInChI=1S/C16H27N3O2/c1-16(2,3)21-15-13(17)5-6-14(18-15)19-9-7-12(8-10-19)11-20-4/h5-6,12H,7-11,17H2,1-4H3
InChIKeySFOQTXSUFBGRNG-UHFFFAOYSA-N
XLogP2.70
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 63972677) is 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is COCC1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1.
What is the InChIKey of 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is SFOQTXSUFBGRNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-16(2,3)21-15-13(17)5-6-14(18-15)19-9-7-12(8-10-19)11-20-4/h5-6,12H,7-11,17H2,1-4H3.
What are the key properties of 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 293.41 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 63972677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).