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

C15H26N4O — CID 43260661

IUPAC6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCCN1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1
InChIInChI=1S/C15H26N4O/c1-5-18-8-10-19(11-9-18)13-7-6-12(16)14(17-13)20-15(2,3)4/h6-7H,5,8-11,16H2,1-4H3
InChIKeyOGEGBLKGXZFEGU-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.98
Rot. Bonds3

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

6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 43260661) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID43260661
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCCN1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1
InChIInChI=1S/C15H26N4O/c1-5-18-8-10-19(11-9-18)13-7-6-12(16)14(17-13)20-15(2,3)4/h6-7H,5,8-11,16H2,1-4H3
InChIKeyOGEGBLKGXZFEGU-UHFFFAOYSA-N
XLogP1.98
TPSA54.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 43260661) is 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is CCN1CCN(c2ccc(N)c(OC(C)(C)C)n2)CC1.
What is the InChIKey of 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is OGEGBLKGXZFEGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-5-18-8-10-19(11-9-18)13-7-6-12(16)14(17-13)20-15(2,3)4/h6-7H,5,8-11,16H2,1-4H3.
What are the key properties of 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 278.40 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethylpiperazin-1-yl)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 43260661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).