3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine

C15H22N4 — CID 117166372

IUPAC3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine
SMILESCC(C)c1nc2cccnc2n1C1CCCN(C)C1
InChIInChI=1S/C15H22N4/c1-11(2)14-17-13-7-4-8-16-15(13)19(14)12-6-5-9-18(3)10-12/h4,7-8,11-12H,5-6,9-10H2,1-3H3
InChIKeySUBRFMRXSRSZGE-UHFFFAOYSA-N
MW258.37 g/mol
LogP2.82
Rot. Bonds2

About 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine

3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine (PubChem CID 117166372) has the molecular formula C15H22N4 and a molecular weight of 258.37 g/mol. Its IUPAC name is 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine
PubChem CID117166372
Molecular FormulaC15H22N4
Molecular Weight258.37 g/mol
Exact Mass258.18
IUPAC Name3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine
SMILESCC(C)c1nc2cccnc2n1C1CCCN(C)C1
InChIInChI=1S/C15H22N4/c1-11(2)14-17-13-7-4-8-16-15(13)19(14)12-6-5-9-18(3)10-12/h4,7-8,11-12H,5-6,9-10H2,1-3H3
InChIKeySUBRFMRXSRSZGE-UHFFFAOYSA-N
XLogP2.82
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-(1-methylpiperidin-3-yl)-2-[(1-methylpyrrolidin-3-yl)methyl]imidazo[4,5-b]pyridine
CID 117161161
3-(1-methylpiperidin-3-yl)-2-(oxan-4-yl)imidazo[4,5-b]pyridine
CID 117160734
3-(1-methylpiperidin-3-yl)-2-(5-methylthiophen-2-yl)imidazo[4,5-b]pyridine
CID 117164272
2-(2-methoxyethyl)-3-(1-methylpiperidin-3-yl)imidazo[4,5-b]pyridine
CID 117159854
2-methyl-3-[(3S)-1-methylpyrrolidin-3-yl]imidazo[4,5-b]pyridine
CID 53017611
3-(1-methylpiperidin-3-yl)-2-(piperidin-4-ylmethyl)imidazo[4,5-b]pyridine
CID 117161554
3-(1-methylpiperidin-3-yl)-2-piperidin-3-ylimidazo[4,5-b]pyridine
CID 117161854
cyclobutyl-[4-(2-propan-2-ylimidazo[4,5-b]pyridin-3-yl)piperidin-1-yl]methanone
CID 42431837
3-(1-methylpiperidin-3-yl)-2-(thiolan-2-ylmethyl)imidazo[4,5-b]pyridine
CID 117163261
2-propan-2-yl-3-pyrrolidin-2-ylimidazo[4,5-b]pyridine
CID 117166385
2-(1-ethylpiperidin-3-yl)-3-(1-methylpyrrolidin-3-yl)imidazo[4,5-b]pyridine
CID 117161788
3-(1-methylpyrrolidin-3-yl)-2-[(1-methylpyrrolidin-2-yl)methyl]imidazo[4,5-b]pyridine
CID 117163191

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine?
The IUPAC name of 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine (CID 117166372) is 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine.
What is the SMILES notation for 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine?
The canonical SMILES for 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine is CC(C)c1nc2cccnc2n1C1CCCN(C)C1.
What is the InChIKey of 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine?
The InChIKey is SUBRFMRXSRSZGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4/c1-11(2)14-17-13-7-4-8-16-15(13)19(14)12-6-5-9-18(3)10-12/h4,7-8,11-12H,5-6,9-10H2,1-3H3.
What are the key properties of 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine?
3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine has a molecular weight of 258.37 g/mol, XLogP of 2.82, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazo[4,5-b]pyridine is sourced from PubChem (CID 117166372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).