2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine

C17H29N3O — CID 83053501

IUPAC2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine
SMILESCCCC1CCCCN1c1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C17H29N3O/c1-5-8-13-9-6-7-12-20(13)15-11-10-14(18)16(19-15)21-17(2,3)4/h10-11,13H,5-9,12,18H2,1-4H3
InChIKeyLTYQLXCNVNTBGP-UHFFFAOYSA-N
MW291.44 g/mol
LogP4.00
Rot. Bonds4

About 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine

2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine (PubChem CID 83053501) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine
PubChem CID83053501
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine
SMILESCCCC1CCCCN1c1ccc(N)c(OC(C)(C)C)n1
InChIInChI=1S/C17H29N3O/c1-5-8-13-9-6-7-12-20(13)15-11-10-14(18)16(19-15)21-17(2,3)4/h10-11,13H,5-9,12,18H2,1-4H3
InChIKeyLTYQLXCNVNTBGP-UHFFFAOYSA-N
XLogP4.00
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine (CID 83053501) is 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine is CCCC1CCCCN1c1ccc(N)c(OC(C)(C)C)n1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine?
The InChIKey is LTYQLXCNVNTBGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-8-13-9-6-7-12-20(13)15-11-10-14(18)16(19-15)21-17(2,3)4/h10-11,13H,5-9,12,18H2,1-4H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine?
2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine has a molecular weight of 291.44 g/mol, XLogP of 4.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine is sourced from PubChem (CID 83053501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).