2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine

C12H16N4 — CID 117165723

IUPAC2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine
SMILESCCc1nc2cccnc2n1C1CCCN1
InChIInChI=1S/C12H16N4/c1-2-10-15-9-5-3-8-14-12(9)16(10)11-6-4-7-13-11/h3,5,8,11,13H,2,4,6-7H2,1H3
InChIKeyDDMHQENIUXPQBF-UHFFFAOYSA-N
MW216.29 g/mol
LogP1.88
Rot. Bonds2

About 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine

2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine (PubChem CID 117165723) has the molecular formula C12H16N4 and a molecular weight of 216.29 g/mol. Its IUPAC name is 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine
PubChem CID117165723
Molecular FormulaC12H16N4
Molecular Weight216.29 g/mol
Exact Mass216.14
IUPAC Name2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine
SMILESCCc1nc2cccnc2n1C1CCCN1
InChIInChI=1S/C12H16N4/c1-2-10-15-9-5-3-8-14-12(9)16(10)11-6-4-7-13-11/h3,5,8,11,13H,2,4,6-7H2,1H3
InChIKeyDDMHQENIUXPQBF-UHFFFAOYSA-N
XLogP1.88
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.29
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-methylphenyl)methyl]-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117165419
3-pyrrolidin-2-yl-2-(pyrrolidin-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117161180
2-propan-2-yl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117166385
3-pyrrolidin-2-yl-2-(thian-3-ylmethyl)imidazo[4,5-b]pyridine
CID 117163944
3-piperidin-2-yl-2-(thian-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117163688
2-(1-methylpyrrolidin-2-yl)-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117162334
3-piperidin-2-yl-2-pyridin-2-ylimidazo[4,5-b]pyridine
CID 117164809
2-ethyl-3-(1-ethylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117165731
2-ethyl-3-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
CID 117165751
4-(2-ethylimidazo[4,5-b]pyridin-3-yl)thiane 1,1-dioxide
CID 117165614
2-(5-chlorothiophen-2-yl)-3-piperidin-2-ylimidazo[4,5-b]pyridine
CID 117164334
3-(1-methylpiperidin-4-yl)-2-(pyrrolidin-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117163215

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine?
The IUPAC name of 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine (CID 117165723) is 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine is CCc1nc2cccnc2n1C1CCCN1.
What is the InChIKey of 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine?
The InChIKey is DDMHQENIUXPQBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4/c1-2-10-15-9-5-3-8-14-12(9)16(10)11-6-4-7-13-11/h3,5,8,11,13H,2,4,6-7H2,1H3.
What are the key properties of 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine?
2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine has a molecular weight of 216.29 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 117165723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).