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

C14H20N4O — CID 117159614

IUPAC3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESCN1CCCC1n1c(CCCO)nc2cccnc21
InChIInChI=1S/C14H20N4O/c1-17-9-3-7-13(17)18-12(6-4-10-19)16-11-5-2-8-15-14(11)18/h2,5,8,13,19H,3-4,6-7,9-10H2,1H3
InChIKeySXJZCQHJUPHSIE-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.58
Rot. Bonds4

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

3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (PubChem CID 117159614) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
PubChem CID117159614
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESCN1CCCC1n1c(CCCO)nc2cccnc21
InChIInChI=1S/C14H20N4O/c1-17-9-3-7-13(17)18-12(6-4-10-19)16-11-5-2-8-15-14(11)18/h2,5,8,13,19H,3-4,6-7,9-10H2,1H3
InChIKeySXJZCQHJUPHSIE-UHFFFAOYSA-N
XLogP1.58
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(1-methylpiperidin-2-yl)-2-propylimidazo[4,5-b]pyridine
CID 117165753
3-[3-(1-propan-2-ylpiperidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159631
2-ethyl-3-(1-methylpiperidin-2-yl)imidazo[4,5-b]pyridine
CID 117165751
2-[3-(1-ethylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117159869
2-[3-(1-propan-2-ylpiperidin-2-yl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117159884
3-[3-(oxan-4-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159557
2,3-bis(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117162335
3-[2-[(1-methylpyrrolidin-2-yl)methyl]imidazo[4,5-b]pyridin-3-yl]propan-1-ol
CID 117163152
3-(1-methylpyrrolidin-2-yl)-2-(1-methylpyrrolidin-3-yl)imidazo[4,5-b]pyridine
CID 117160229
2-ethyl-3-(1-ethylpyrrolidin-2-yl)imidazo[4,5-b]pyridine
CID 117165731
2-[2-[(1-methylpyrrolidin-2-yl)methyl]imidazo[4,5-b]pyridin-3-yl]ethanol
CID 117163166
3-[3-(2-piperidin-1-ylethyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159774

Frequently Asked Questions

What is the IUPAC name of 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The IUPAC name of 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (CID 117159614) is 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The canonical SMILES for 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is CN1CCCC1n1c(CCCO)nc2cccnc21.
What is the InChIKey of 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The InChIKey is SXJZCQHJUPHSIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-17-9-3-7-13(17)18-12(6-4-10-19)16-11-5-2-8-15-14(11)18/h2,5,8,13,19H,3-4,6-7,9-10H2,1H3.
What are the key properties of 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol has a molecular weight of 260.34 g/mol, XLogP of 1.58, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(1-methylpyrrolidin-2-yl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is sourced from PubChem (CID 117159614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).