3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol

C16H24N4O — CID 117159774

IUPAC3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESOCCCc1nc2cccnc2n1CCN1CCCCC1
InChIInChI=1S/C16H24N4O/c21-13-5-7-15-18-14-6-4-8-17-16(14)20(15)12-11-19-9-2-1-3-10-19/h4,6,8,21H,1-3,5,7,9-13H2
InChIKeyHMVVPCHYHKIBFH-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.84
Rot. Bonds6

About 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol

3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (PubChem CID 117159774) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
PubChem CID117159774
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESOCCCc1nc2cccnc2n1CCN1CCCCC1
InChIInChI=1S/C16H24N4O/c21-13-5-7-15-18-14-6-4-8-17-16(14)20(15)12-11-19-9-2-1-3-10-19/h4,6,8,21H,1-3,5,7,9-13H2
InChIKeyHMVVPCHYHKIBFH-UHFFFAOYSA-N
XLogP1.84
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-chloroethyl)-3-(2-pyrrolidin-1-ylethyl)imidazo[4,5-b]pyridine
CID 79294892
3-(2-ethoxyethyl)-2-(3-piperidin-1-ylpropyl)imidazo[4,5-b]pyridine
CID 14855700
2-(2,2-dimethylpropyl)-3-(2-pyrrolidin-1-ylethyl)imidazo[4,5-b]pyridine
CID 117166070
3-[3-(oxolan-2-ylmethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159634
3-[2-[(1-methylpyrrolidin-2-yl)methyl]imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 117163152
3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159614
2-[2-[(1-methylpiperidin-2-yl)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol
CID 117163596
2-(1-chloroethyl)-3-(2-pyrrolidin-1-ylethyl)imidazo[4,5-b]pyridine
CID 79294964
2-[2-[(1-methylpyrrolidin-2-yl)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol
CID 117163166
3-[3-[(3-chlorophenyl)methyl]imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159690
3-[2-(oxan-4-ylmethyl)imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 117161472
3-(2-methoxyethyl)-2-[3-[3-(2-methoxyethyl)imidazo[4,5-b]pyridin-2-yl]propyl]imidazo[4,5-b]pyridine
CID 20955418

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The IUPAC name of 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (CID 117159774) is 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The canonical SMILES for 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is OCCCc1nc2cccnc2n1CCN1CCCCC1.
What is the InChIKey of 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The InChIKey is HMVVPCHYHKIBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c21-13-5-7-15-18-14-6-4-8-17-16(14)20(15)12-11-19-9-2-1-3-10-19/h4,6,8,21H,1-3,5,7,9-13H2.
What are the key properties of 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol has a molecular weight of 288.39 g/mol, XLogP of 1.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is sourced from PubChem (CID 117159774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).