4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine

C18H15ClFN7O — CID 139344356

IUPAC4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine
SMILESFc1cc2ncc(-c3nccc(N4CCOC(c5cn[nH]c5)C4)n3)n2cc1Cl
InChIInChI=1S/C18H15ClFN7O/c19-12-9-27-14(8-22-17(27)5-13(12)20)18-21-2-1-16(25-18)26-3-4-28-15(10-26)11-6-23-24-7-11/h1-2,5-9,15H,3-4,10H2,(H,23,24)
InChIKeyRTPSJRJLVLSFEG-UHFFFAOYSA-N
MW399.82 g/mol
LogP2.88
Rot. Bonds3

About 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine

4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine (PubChem CID 139344356) has the molecular formula C18H15ClFN7O and a molecular weight of 399.82 g/mol. Its IUPAC name is 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine.

Molecular Properties

Compound Name4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine
PubChem CID139344356
Molecular FormulaC18H15ClFN7O
Molecular Weight399.82 g/mol
Exact Mass399.10
IUPAC Name4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine
SMILESFc1cc2ncc(-c3nccc(N4CCOC(c5cn[nH]c5)C4)n3)n2cc1Cl
InChIInChI=1S/C18H15ClFN7O/c19-12-9-27-14(8-22-17(27)5-13(12)20)18-21-2-1-16(25-18)26-3-4-28-15(10-26)11-6-23-24-7-11/h1-2,5-9,15H,3-4,10H2,(H,23,24)
InChIKeyRTPSJRJLVLSFEG-UHFFFAOYSA-N
XLogP2.88
TPSA84.23 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.82
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine 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 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine?
The IUPAC name of 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine (CID 139344356) is 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine.
What is the SMILES notation for 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine?
The canonical SMILES for 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine is Fc1cc2ncc(-c3nccc(N4CCOC(c5cn[nH]c5)C4)n3)n2cc1Cl.
What is the InChIKey of 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine?
The InChIKey is RTPSJRJLVLSFEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClFN7O/c19-12-9-27-14(8-22-17(27)5-13(12)20)18-21-2-1-16(25-18)26-3-4-28-15(10-26)11-6-23-24-7-11/h1-2,5-9,15H,3-4,10H2,(H,23,24).
What are the key properties of 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine?
4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine has a molecular weight of 399.82 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(6-chloro-7-fluoroimidazo[1,2-a]pyridin-3-yl)pyrimidin-4-yl]-2-(1H-pyrazol-4-yl)morpholine is sourced from PubChem (CID 139344356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).