3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine

C22H23N5O — CID 42602630

IUPAC3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine
SMILESCCOc1ccc(-n2cnc3cc(NCc4ccc(CC)cc4)cnc32)cn1
InChIInChI=1S/C22H23N5O/c1-3-16-5-7-17(8-6-16)12-23-18-11-20-22(25-13-18)27(15-26-20)19-9-10-21(24-14-19)28-4-2/h5-11,13-15,23H,3-4,12H2,1-2H3
InChIKeyWFUALLAHVBHOCP-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.39
Rot. Bonds7

About 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine

3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine (PubChem CID 42602630) has the molecular formula C22H23N5O and a molecular weight of 373.46 g/mol. Its IUPAC name is 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine.

Molecular Properties

Compound Name3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine
PubChem CID42602630
Molecular FormulaC22H23N5O
Molecular Weight373.46 g/mol
Exact Mass373.19
IUPAC Name3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine
SMILESCCOc1ccc(-n2cnc3cc(NCc4ccc(CC)cc4)cnc32)cn1
InChIInChI=1S/C22H23N5O/c1-3-16-5-7-17(8-6-16)12-23-18-11-20-22(25-13-18)27(15-26-20)19-9-10-21(24-14-19)28-4-2/h5-11,13-15,23H,3-4,12H2,1-2H3
InChIKeyWFUALLAHVBHOCP-UHFFFAOYSA-N
XLogP4.39
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine with MolForge

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Related Compounds

N4-methyl-N2-{2-methyl-1-[2-({3-methyl-3H-imidazo[4,5-b]pyridin-6-yl}oxy)phenyl]-1H-indol-6-yl}pyrimidine-2,4-diamine
CID 121231410
7-butyl-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 3641059
4-[2-Methyl-3-(2-phenoxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335939
Meriolin 5
CID 23727982
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
N'-(8-ethoxy-5H-pyrimido[5,4-b]indol-4-yl)-N,N-dimethylethane-1,2-diamine
CID 943137
3-(6-Methoxypyridin-2-yl)-7-phenylimidazo[1,2-a]pyridine
CID 5329342
Benzimidazole deriv. 5
CID 5329405
1-[2-(4-{3-phenyl-3H-imidazo[4,5-b]pyridin-6-yl}phenoxy)ethyl]piperidine
CID 5329413
2,4-Disubstituted Pyrimidine 2g
CID 5329420
6-(4-methoxyphenyl)-7-methyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538782
6-(4-methoxyphenyl)-7-propyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538784

Frequently Asked Questions

What is the IUPAC name of 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine?
The IUPAC name of 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine (CID 42602630) is 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine.
What is the SMILES notation for 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine?
The canonical SMILES for 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine is CCOc1ccc(-n2cnc3cc(NCc4ccc(CC)cc4)cnc32)cn1.
What is the InChIKey of 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine?
The InChIKey is WFUALLAHVBHOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O/c1-3-16-5-7-17(8-6-16)12-23-18-11-20-22(25-13-18)27(15-26-20)19-9-10-21(24-14-19)28-4-2/h5-11,13-15,23H,3-4,12H2,1-2H3.
What are the key properties of 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine?
3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine has a molecular weight of 373.46 g/mol, XLogP of 4.39, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-ethoxy-3-pyridinyl)-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine is sourced from PubChem (CID 42602630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).