1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol

C16H27N3O2 — CID 106835333

IUPAC1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1
InChIInChI=1S/C16H27N3O2/c1-11(20)12-7-9-19(10-8-12)14-6-5-13(17)15(18-14)21-16(2,3)4/h5-6,11-12,20H,7-10,17H2,1-4H3
InChIKeyCNGKNLMZSSOZSR-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.44
Rot. Bonds3

About 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol

1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol (PubChem CID 106835333) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol.

Molecular Properties

Compound Name1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol
PubChem CID106835333
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol
SMILESCC(O)C1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1
InChIInChI=1S/C16H27N3O2/c1-11(20)12-7-9-19(10-8-12)14-6-5-13(17)15(18-14)21-16(2,3)4/h5-6,11-12,20H,7-10,17H2,1-4H3
InChIKeyCNGKNLMZSSOZSR-UHFFFAOYSA-N
XLogP2.44
TPSA71.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(azocan-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43260821
6-[4-(methoxymethyl)piperidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 63972677
6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43260661
6-(4-ethyl-4-methylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 63405995
6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 43581406
1-[1-(5-amino-6-methyl-2-pyridinyl)pyrrolidin-3-yl]ethanol
CID 112624182
6-(2,4-dimethylpiperidin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 62332285
1-(5-amino-6-ethoxy-2-pyridinyl)piperidin-4-ol
CID 43260641
6-[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
CID 81451106
2-[(2-methylpropan-2-yl)oxy]-6-(2-propylpiperidin-1-yl)pyridin-3-amine
CID 83053501
1-[1-(6-methoxy-2-pyridinyl)piperidin-4-yl]ethanol
CID 106837299
6-(4-methylpiperidin-1-yl)-2-(2-methylpropoxy)pyridin-3-amine
CID 43260529

Frequently Asked Questions

What is the IUPAC name of 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol?
The IUPAC name of 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol (CID 106835333) is 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol.
What is the SMILES notation for 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol?
The canonical SMILES for 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol is CC(O)C1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1.
What is the InChIKey of 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol?
The InChIKey is CNGKNLMZSSOZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c1-11(20)12-7-9-19(10-8-12)14-6-5-13(17)15(18-14)21-16(2,3)4/h5-6,11-12,20H,7-10,17H2,1-4H3.
What are the key properties of 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol?
1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol has a molecular weight of 293.41 g/mol, XLogP of 2.44, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]piperidin-4-yl]ethanol is sourced from PubChem (CID 106835333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).