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

C16H17N3O2 — CID 117159759

IUPAC3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESCOc1ccc(-n2c(CCCO)nc3cccnc32)cc1
InChIInChI=1S/C16H17N3O2/c1-21-13-8-6-12(7-9-13)19-15(5-3-11-20)18-14-4-2-10-17-16(14)19/h2,4,6-10,20H,3,5,11H2,1H3
InChIKeyKPIRZDKIOWEPJO-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.35
Rot. Bonds5

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

3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (PubChem CID 117159759) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
PubChem CID117159759
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
SMILESCOc1ccc(-n2c(CCCO)nc3cccnc32)cc1
InChIInChI=1S/C16H17N3O2/c1-21-13-8-6-12(7-9-13)19-15(5-3-11-20)18-14-4-2-10-17-16(14)19/h2,4,6-10,20H,3,5,11H2,1H3
InChIKeyKPIRZDKIOWEPJO-UHFFFAOYSA-N
XLogP2.35
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-(3-methylphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159732
3-(4-methoxyphenyl)-2-propan-2-ylimidazo[4,5-b]pyridine
CID 117166531
[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
CID 82487584
2-[3-(3-methylphenyl)imidazo[4,5-b]pyridin-2-yl]ethanol
CID 117159986
3-(4-methylphenyl)-2-[[3-(4-methylphenyl)imidazo[4,5-b]pyridin-2-yl]methoxymethyl]imidazo[4,5-b]pyridine
CID 20955885
N-tert-butyl-4-[[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methyl]piperazine-1-carboxamide
CID 53022630
2-(2-chloroethyl)-3-(4-methoxy-3-methylphenyl)imidazo[4,5-b]pyridine
CID 79274031
3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 58345186
2-(2-chloroethyl)-3-(4-propylphenyl)imidazo[4,5-b]pyridine
CID 79273871
3-(2-methoxyphenyl)-2-(3-methoxypropyl)imidazo[4,5-b]pyridine
CID 117159751
N-butan-2-yl-4-[[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methyl]piperazine-1-carboxamide
CID 53022625
4-ethyl-6-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]benzene-1,3-diol
CID 178120474

Frequently Asked Questions

What is the IUPAC name of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The IUPAC name of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol (CID 117159759) is 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The canonical SMILES for 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is COc1ccc(-n2c(CCCO)nc3cccnc32)cc1.
What is the InChIKey of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
The InChIKey is KPIRZDKIOWEPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-21-13-8-6-12(7-9-13)19-15(5-3-11-20)18-14-4-2-10-17-16(14)19/h2,4,6-10,20H,3,5,11H2,1H3.
What are the key properties of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol?
3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol has a molecular weight of 283.33 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol is sourced from PubChem (CID 117159759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).