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

C16H27N3O — CID 43260821

IUPAC6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCC(C)(C)Oc1nc(N2CCCCCCC2)ccc1N
InChIInChI=1S/C16H27N3O/c1-16(2,3)20-15-13(17)9-10-14(18-15)19-11-7-5-4-6-8-12-19/h9-10H,4-8,11-12,17H2,1-3H3
InChIKeyYRPZQGXGBWHJLZ-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.61
Rot. Bonds2

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

6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 43260821) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID43260821
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC Name6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCC(C)(C)Oc1nc(N2CCCCCCC2)ccc1N
InChIInChI=1S/C16H27N3O/c1-16(2,3)20-15-13(17)9-10-14(18-15)19-11-7-5-4-6-8-12-19/h9-10H,4-8,11-12,17H2,1-3H3
InChIKeyYRPZQGXGBWHJLZ-UHFFFAOYSA-N
XLogP3.61
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43260661
6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43581406
6-(4-ethyl-4-methylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 63405995
6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 63972677
1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol
CID 106835333
2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine
CID 83053501
6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 81451106
6-(2,3-dihydroindol-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43260703
6-(2,4-dimethylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 62332285
2-[(2-methylpropan-2-yl)oxy]-6-(3-propan-2-ylpyrazol-1-yl)pyridin-3-amine
CID 62488629
CID 59095153
CID 59095153
tert-butyl 4-(5-amino-6-methoxy-2-pyridinyl)piperazine-1-carboxylate;ethane
CID 145279147

Frequently Asked Questions

What is the IUPAC name of 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 43260821) is 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is CC(C)(C)Oc1nc(N2CCCCCCC2)ccc1N.
What is the InChIKey of 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is YRPZQGXGBWHJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-16(2,3)20-15-13(17)9-10-14(18-15)19-11-7-5-4-6-8-12-19/h9-10H,4-8,11-12,17H2,1-3H3.
What are the key properties of 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 277.41 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 43260821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).