4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine

C16H23N5O — CID 117162702

IUPAC4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine
SMILESc1cnc2c(c1)nc(C1CCCN1)n2CCN1CCOCC1
InChIInChI=1S/C16H23N5O/c1-3-13(17-5-1)16-19-14-4-2-6-18-15(14)21(16)8-7-20-9-11-22-12-10-20/h2,4,6,13,17H,1,3,5,7-12H2
InChIKeyITQGYQSURMKCIE-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.19
Rot. Bonds4

About 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine

4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine (PubChem CID 117162702) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine
PubChem CID117162702
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC Name4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine
SMILESc1cnc2c(c1)nc(C1CCCN1)n2CCN1CCOCC1
InChIInChI=1S/C16H23N5O/c1-3-13(17-5-1)16-19-14-4-2-6-18-15(14)21(16)8-7-20-9-11-22-12-10-20/h2,4,6,13,17H,1,3,5,7-12H2
InChIKeyITQGYQSURMKCIE-UHFFFAOYSA-N
XLogP1.19
TPSA55.21 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-[2-(2-pyrrolidin-3-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine
CID 117160602
3-(oxan-2-ylmethyl)-2-piperidin-2-ylimidazo[4,5-b]pyridine
CID 117162925
3-[(1-ethylpiperidin-3-yl)methyl]-2-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117162442
2-pyrrolidin-2-yl-3-(thian-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117162436
3-(oxolan-3-yl)-2-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117162190
2-(1-methylpyrrolidin-2-yl)-3-(2-pyrrolidin-1-ylethyl)imidazo[4,5-b]pyridine
CID 117162694
2-(oxan-3-yl)-3-(pyrrolidin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117161910
3-(1-methylpiperidin-2-yl)-2-piperidin-2-ylimidazo[4,5-b]pyridine
CID 117162893
2-(oxan-4-yl)-3-(piperidin-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117160831
3-(4-methoxyphenyl)-2-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117162657
2-(oxan-4-yl)-3-(piperidin-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117160721
3-(4-methylphenyl)-2-piperidin-2-ylimidazo[4,5-b]pyridine
CID 117163089

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine (CID 117162702) is 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine is c1cnc2c(c1)nc(C1CCCN1)n2CCN1CCOCC1.
What is the InChIKey of 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine?
The InChIKey is ITQGYQSURMKCIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-3-13(17-5-1)16-19-14-4-2-6-18-15(14)21(16)8-7-20-9-11-22-12-10-20/h2,4,6,13,17H,1,3,5,7-12H2.
What are the key properties of 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine?
4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine has a molecular weight of 301.39 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-pyrrolidin-2-ylimidazo[4,5-b]pyridin-3-yl)ethyl]morpholine is sourced from PubChem (CID 117162702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).