6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine

C16H26N4O — CID 116522204

IUPAC6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine
SMILESCC1(C)CCC(CN2CCN(c3ccc(N)cn3)CC2)O1
InChIInChI=1S/C16H26N4O/c1-16(2)6-5-14(21-16)12-19-7-9-20(10-8-19)15-4-3-13(17)11-18-15/h3-4,11,14H,5-10,12,17H2,1-2H3
InChIKeyZRUVORSDHACDFW-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.74
Rot. Bonds3

About 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine

6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine (PubChem CID 116522204) has the molecular formula C16H26N4O and a molecular weight of 290.41 g/mol. Its IUPAC name is 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine.

Molecular Properties

Compound Name6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine
PubChem CID116522204
Molecular FormulaC16H26N4O
Molecular Weight290.41 g/mol
Exact Mass290.21
IUPAC Name6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine
SMILESCC1(C)CCC(CN2CCN(c3ccc(N)cn3)CC2)O1
InChIInChI=1S/C16H26N4O/c1-16(2)6-5-14(21-16)12-19-7-9-20(10-8-19)15-4-3-13(17)11-18-15/h3-4,11,14H,5-10,12,17H2,1-2H3
InChIKeyZRUVORSDHACDFW-UHFFFAOYSA-N
XLogP1.74
TPSA54.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine?
The IUPAC name of 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine (CID 116522204) is 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine.
What is the SMILES notation for 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine?
The canonical SMILES for 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine is CC1(C)CCC(CN2CCN(c3ccc(N)cn3)CC2)O1.
What is the InChIKey of 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine?
The InChIKey is ZRUVORSDHACDFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N4O/c1-16(2)6-5-14(21-16)12-19-7-9-20(10-8-19)15-4-3-13(17)11-18-15/h3-4,11,14H,5-10,12,17H2,1-2H3.
What are the key properties of 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine?
6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine has a molecular weight of 290.41 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[(5,5-dimethyloxolan-2-yl)methyl]piperazin-1-yl]pyridin-3-amine is sourced from PubChem (CID 116522204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).