4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine

C22H20FN5O — CID 86268999

IUPAC4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine
SMILESCc1cc(N2CCOCC2)ncc1-c1nc2ccncc2n1-c1ccc(F)cc1
InChIInChI=1S/C22H20FN5O/c1-15-12-21(27-8-10-29-11-9-27)25-13-18(15)22-26-19-6-7-24-14-20(19)28(22)17-4-2-16(23)3-5-17/h2-7,12-14H,8-11H2,1H3
InChIKeyQCSDQBSFPQLPON-UHFFFAOYSA-N
MW389.43 g/mol
LogP3.77
Rot. Bonds3

About 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine

4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine (PubChem CID 86268999) has the molecular formula C22H20FN5O and a molecular weight of 389.43 g/mol. Its IUPAC name is 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine
PubChem CID86268999
Molecular FormulaC22H20FN5O
Molecular Weight389.43 g/mol
Exact Mass389.17
IUPAC Name4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine
SMILESCc1cc(N2CCOCC2)ncc1-c1nc2ccncc2n1-c1ccc(F)cc1
InChIInChI=1S/C22H20FN5O/c1-15-12-21(27-8-10-29-11-9-27)25-13-18(15)22-26-19-6-7-24-14-20(19)28(22)17-4-2-16(23)3-5-17/h2-7,12-14H,8-11H2,1H3
InChIKeyQCSDQBSFPQLPON-UHFFFAOYSA-N
XLogP3.77
TPSA56.07 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.43
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine (CID 86268999) is 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine is Cc1cc(N2CCOCC2)ncc1-c1nc2ccncc2n1-c1ccc(F)cc1.
What is the InChIKey of 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine?
The InChIKey is QCSDQBSFPQLPON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN5O/c1-15-12-21(27-8-10-29-11-9-27)25-13-18(15)22-26-19-6-7-24-14-20(19)28(22)17-4-2-16(23)3-5-17/h2-7,12-14H,8-11H2,1H3.
What are the key properties of 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine?
4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine has a molecular weight of 389.43 g/mol, XLogP of 3.77, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[3-(4-fluorophenyl)imidazo[4,5-c]pyridin-2-yl]-4-methyl-2-pyridinyl]morpholine is sourced from PubChem (CID 86268999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).