4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine

C16H16N4O — CID 141372459

IUPAC4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine
SMILESc1cc2cc(-c3ccc(N4CCOCC4)nc3)cnc2[nH]1
InChIInChI=1S/C16H16N4O/c1-2-15(20-5-7-21-8-6-20)18-10-13(1)14-9-12-3-4-17-16(12)19-11-14/h1-4,9-11H,5-8H2,(H,17,19)
InChIKeyOUGKWLUGMLXQFW-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.46
Rot. Bonds2

About 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine

4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine (PubChem CID 141372459) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine
PubChem CID141372459
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC Name4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine
SMILESc1cc2cc(-c3ccc(N4CCOCC4)nc3)cnc2[nH]1
InChIInChI=1S/C16H16N4O/c1-2-15(20-5-7-21-8-6-20)18-10-13(1)14-9-12-3-4-17-16(12)19-11-14/h1-4,9-11H,5-8H2,(H,17,19)
InChIKeyOUGKWLUGMLXQFW-UHFFFAOYSA-N
XLogP2.46
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[6-methyl-5-[(6-morpholin-4-yl-3-pyridinyl)methylsulfanyl]-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidin-4-yl]morpholine
CID 143572306
4-[6-(2-methylsulfanylpropan-2-yl)-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)pyrimidin-4-yl]morpholine
CID 143742170
4-(5-pyridin-4-yl-2-pyridinyl)morpholine
CID 10377044
4-[5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-pyridinyl]morpholine
CID 58507795
(E)-3-[5-(6-morpholin-4-yl-3-pyridinyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]prop-2-enamide
CID 118267720
5-(6-morpholin-4-yl-3-pyridinyl)-N-phenylpyridine-3-carboxamide
CID 117089330
N-methyl-1-[4-morpholin-4-yl-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)thieno[3,2-d]pyrimidin-6-yl]methanamine
CID 59592837
5-(2-methylpyrimidin-5-yl)-1H-pyrrolo[2,3-b]pyridine
CID 140781014
5-[4-[4-(1-methylpiperidin-4-yl)piperazin-1-yl]phenyl]-1H-pyrrolo[2,3-b]pyridine
CID 151650457
6-methyl-2-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-amine
CID 117085161
6,6-dimethyl-4-morpholin-4-yl-2-(1H-pyrrolo[2,3-b]pyridin-5-yl)-8,9-dihydropurino[8,9-c][1,4]oxazine
CID 57385104
6-(1H-pyrrolo[2,3-b]pyridin-5-yl)quinoxaline
CID 141301480

Frequently Asked Questions

What is the IUPAC name of 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine (CID 141372459) is 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine is c1cc2cc(-c3ccc(N4CCOCC4)nc3)cnc2[nH]1.
What is the InChIKey of 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine?
The InChIKey is OUGKWLUGMLXQFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-2-15(20-5-7-21-8-6-20)18-10-13(1)14-9-12-3-4-17-16(12)19-11-14/h1-4,9-11H,5-8H2,(H,17,19).
What are the key properties of 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine?
4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine has a molecular weight of 280.33 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(1H-pyrrolo[2,3-b]pyridin-5-yl)-2-pyridinyl]morpholine is sourced from PubChem (CID 141372459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).