2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol

C16H21N3O2 — CID 63182610

IUPAC2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol
SMILESCC(C)Oc1nc(NC(CO)c2ccccc2)ccc1N
InChIInChI=1S/C16H21N3O2/c1-11(2)21-16-13(17)8-9-15(19-16)18-14(10-20)12-6-4-3-5-7-12/h3-9,11,14,20H,10,17H2,1-2H3,(H,18,19)
InChIKeyWIJCHTPOYONYJM-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.60
Rot. Bonds6

About 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol

2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol (PubChem CID 63182610) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol.

Molecular Properties

Compound Name2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol
PubChem CID63182610
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol
SMILESCC(C)Oc1nc(NC(CO)c2ccccc2)ccc1N
InChIInChI=1S/C16H21N3O2/c1-11(2)21-16-13(17)8-9-15(19-16)18-14(10-20)12-6-4-3-5-7-12/h3-9,11,14,20H,10,17H2,1-2H3,(H,18,19)
InChIKeyWIJCHTPOYONYJM-UHFFFAOYSA-N
XLogP2.60
TPSA80.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol 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 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol?
The IUPAC name of 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol (CID 63182610) is 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol.
What is the SMILES notation for 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol?
The canonical SMILES for 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol is CC(C)Oc1nc(NC(CO)c2ccccc2)ccc1N.
What is the InChIKey of 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol?
The InChIKey is WIJCHTPOYONYJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-11(2)21-16-13(17)8-9-15(19-16)18-14(10-20)12-6-4-3-5-7-12/h3-9,11,14,20H,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol?
2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol has a molecular weight of 287.36 g/mol, XLogP of 2.60, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-propan-2-yloxy-2-pyridinyl)amino]-2-phenylethanol is sourced from PubChem (CID 63182610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).