3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine

C21H26N4O — CID 10360548

IUPAC3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine
SMILESCCc1nc2c(-c3ccc(OC)nc3C)ccnc2n1C(CC)C1CC1
InChIInChI=1S/C21H26N4O/c1-5-17(14-7-8-14)25-18(6-2)24-20-16(11-12-22-21(20)25)15-9-10-19(26-4)23-13(15)3/h9-12,14,17H,5-8H2,1-4H3
InChIKeyMOELLDVFCGIHRI-UHFFFAOYSA-N
MW350.47 g/mol
LogP4.73
Rot. Bonds6

About 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine

3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine (PubChem CID 10360548) has the molecular formula C21H26N4O and a molecular weight of 350.47 g/mol. Its IUPAC name is 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine
PubChem CID10360548
Molecular FormulaC21H26N4O
Molecular Weight350.47 g/mol
Exact Mass350.21
IUPAC Name3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine
SMILESCCc1nc2c(-c3ccc(OC)nc3C)ccnc2n1C(CC)C1CC1
InChIInChI=1S/C21H26N4O/c1-5-17(14-7-8-14)25-18(6-2)24-20-16(11-12-22-21(20)25)15-9-10-19(26-4)23-13(15)3/h9-12,14,17H,5-8H2,1-4H3
InChIKeyMOELLDVFCGIHRI-UHFFFAOYSA-N
XLogP4.73
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.47
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine?
The IUPAC name of 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine (CID 10360548) is 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine is CCc1nc2c(-c3ccc(OC)nc3C)ccnc2n1C(CC)C1CC1.
What is the InChIKey of 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine?
The InChIKey is MOELLDVFCGIHRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O/c1-5-17(14-7-8-14)25-18(6-2)24-20-16(11-12-22-21(20)25)15-9-10-19(26-4)23-13(15)3/h9-12,14,17H,5-8H2,1-4H3.
What are the key properties of 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine?
3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine has a molecular weight of 350.47 g/mol, XLogP of 4.73, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylpropyl)-2-ethyl-7-(6-methoxy-2-methyl-3-pyridinyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 10360548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).