2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine

C17H19FN6O — CID 67262133

IUPAC2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
SMILESCOc1cc(N[C@@H]2CCCNC2)nc(-c2cnc3ccc(F)cn23)n1
InChIInChI=1S/C17H19FN6O/c1-25-16-7-14(21-12-3-2-6-19-8-12)22-17(23-16)13-9-20-15-5-4-11(18)10-24(13)15/h4-5,7,9-10,12,19H,2-3,6,8H2,1H3,(H,21,22,23)/t12-/m1/s1
InChIKeyFOSHAHGPRSIKJA-GFCCVEGCSA-N
MW342.38 g/mol
LogP2.10
Rot. Bonds4

About 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine

2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine (PubChem CID 67262133) has the molecular formula C17H19FN6O and a molecular weight of 342.38 g/mol. Its IUPAC name is 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
PubChem CID67262133
Molecular FormulaC17H19FN6O
Molecular Weight342.38 g/mol
Exact Mass342.16
IUPAC Name2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
SMILESCOc1cc(N[C@@H]2CCCNC2)nc(-c2cnc3ccc(F)cn23)n1
InChIInChI=1S/C17H19FN6O/c1-25-16-7-14(21-12-3-2-6-19-8-12)22-17(23-16)13-9-20-15-5-4-11(18)10-24(13)15/h4-5,7,9-10,12,19H,2-3,6,8H2,1H3,(H,21,22,23)/t12-/m1/s1
InChIKeyFOSHAHGPRSIKJA-GFCCVEGCSA-N
XLogP2.10
TPSA76.37 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.38
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
The IUPAC name of 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine (CID 67262133) is 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine.
What is the SMILES notation for 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
The canonical SMILES for 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine is COc1cc(N[C@@H]2CCCNC2)nc(-c2cnc3ccc(F)cn23)n1.
What is the InChIKey of 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
The InChIKey is FOSHAHGPRSIKJA-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H19FN6O/c1-25-16-7-14(21-12-3-2-6-19-8-12)22-17(23-16)13-9-20-15-5-4-11(18)10-24(13)15/h4-5,7,9-10,12,19H,2-3,6,8H2,1H3,(H,21,22,23)/t12-/m1/s1.
What are the key properties of 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine has a molecular weight of 342.38 g/mol, XLogP of 2.10, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine is sourced from PubChem (CID 67262133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).