3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine

C18H15N5O — CID 58345186

IUPAC3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
SMILESCOc1ccc(-n2c(-c3cccnc3N)nc3cccnc32)cc1
InChIInChI=1S/C18H15N5O/c1-24-13-8-6-12(7-9-13)23-17(14-4-2-10-20-16(14)19)22-15-5-3-11-21-18(15)23/h2-11H,1H3,(H2,19,20)
InChIKeyITNQMBRIHSMAAJ-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.07
Rot. Bonds3

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

3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine (PubChem CID 58345186) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
PubChem CID58345186
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC Name3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
SMILESCOc1ccc(-n2c(-c3cccnc3N)nc3cccnc32)cc1
InChIInChI=1S/C18H15N5O/c1-24-13-8-6-12(7-9-13)23-17(14-4-2-10-20-16(14)19)22-15-5-3-11-21-18(15)23/h2-11H,1H3,(H2,19,20)
InChIKeyITNQMBRIHSMAAJ-UHFFFAOYSA-N
XLogP3.07
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[3-(4-propylphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 170204603
N-[4-[2-(2-amino-3-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]acetamide
CID 58344944
3-[3-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 58345030
3-[3-[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 171601152
3-[3-[4-(aminomethylsulfonyl)phenyl]imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 67312812
3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
CID 174278837
methyl 4-[2-(2-amino-3-pyridinyl)-5-methoxyimidazo[4,5-b]pyridin-3-yl]benzoate
CID 171494970
lithium 2-[4-[2-(2-amino-3-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]acetate
CID 58345222
4-ethyl-6-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]benzene-1,3-diol
CID 178120474
3-[3-[4-(chloromethyl)phenyl]-5-(4-methoxy-2-pyridinyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 171494268
2-[4-[2-(2-amino-3-pyridinyl)imidazo[4,5-b]pyridin-3-yl]phenyl]butanoic acid
CID 67312274
3-[3-[4-(piperazin-1-ylmethyl)phenyl]imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine
CID 171069116

Frequently Asked Questions

What is the IUPAC name of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
The IUPAC name of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine (CID 58345186) is 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine.
What is the SMILES notation for 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
The canonical SMILES for 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine is COc1ccc(-n2c(-c3cccnc3N)nc3cccnc32)cc1.
What is the InChIKey of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
The InChIKey is ITNQMBRIHSMAAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c1-24-13-8-6-12(7-9-13)23-17(14-4-2-10-20-16(14)19)22-15-5-3-11-21-18(15)23/h2-11H,1H3,(H2,19,20).
What are the key properties of 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine?
3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine has a molecular weight of 317.35 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]pyridin-2-amine is sourced from PubChem (CID 58345186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).