2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine

C15H26N4O — CID 43585063

IUPAC2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine
SMILESCC(C)Oc1nc(N2CCN(C(C)C)CC2)ccc1N
InChIInChI=1S/C15H26N4O/c1-11(2)18-7-9-19(10-8-18)14-6-5-13(16)15(17-14)20-12(3)4/h5-6,11-12H,7-10,16H2,1-4H3
InChIKeyINDHGGCQMMRLRH-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.98
Rot. Bonds4

About 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine

2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine (PubChem CID 43585063) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine
PubChem CID43585063
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine
SMILESCC(C)Oc1nc(N2CCN(C(C)C)CC2)ccc1N
InChIInChI=1S/C15H26N4O/c1-11(2)18-7-9-19(10-8-18)14-6-5-13(16)15(17-14)20-12(3)4/h5-6,11-12H,7-10,16H2,1-4H3
InChIKeyINDHGGCQMMRLRH-UHFFFAOYSA-N
XLogP1.98
TPSA54.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
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 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine?
The IUPAC name of 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine (CID 43585063) is 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine.
What is the SMILES notation for 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine?
The canonical SMILES for 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine is CC(C)Oc1nc(N2CCN(C(C)C)CC2)ccc1N.
What is the InChIKey of 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine?
The InChIKey is INDHGGCQMMRLRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)18-7-9-19(10-8-18)14-6-5-13(16)15(17-14)20-12(3)4/h5-6,11-12H,7-10,16H2,1-4H3.
What are the key properties of 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine?
2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine has a molecular weight of 278.40 g/mol, XLogP of 1.98, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxy-6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-amine is sourced from PubChem (CID 43585063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).