N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine

C13H12N4 — CID 67278158

IUPACN-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine
SMILESCN(c1ccccc1)c1ccnc2nc[nH]c12
InChIInChI=1S/C13H12N4/c1-17(10-5-3-2-4-6-10)11-7-8-14-13-12(11)15-9-16-13/h2-9H,1H3,(H,14,15,16)
InChIKeyCEQWELFRGJQOCC-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.73
Rot. Bonds2

About N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine

N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine (PubChem CID 67278158) has the molecular formula C13H12N4 and a molecular weight of 224.27 g/mol. Its IUPAC name is N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine.

Molecular Properties

Compound NameN-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine
PubChem CID67278158
Molecular FormulaC13H12N4
Molecular Weight224.27 g/mol
Exact Mass224.11
IUPAC NameN-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine
SMILESCN(c1ccccc1)c1ccnc2nc[nH]c12
InChIInChI=1S/C13H12N4/c1-17(10-5-3-2-4-6-10)11-7-8-14-13-12(11)15-9-16-13/h2-9H,1H3,(H,14,15,16)
InChIKeyCEQWELFRGJQOCC-UHFFFAOYSA-N
XLogP2.73
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 1530
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CID 62275
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CID 49970
CID 49970
CID 49971
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CID 247635
CID 247635
CID 51371303
CID 51371303
CID 104954
CID 104954
CID 5025739
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CID 5359646
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CID 70821
CID 70821
CID 5287565
CID 5287565

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine?
The IUPAC name of N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine (CID 67278158) is N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine.
What is the SMILES notation for N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine?
The canonical SMILES for N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine is CN(c1ccccc1)c1ccnc2nc[nH]c12.
What is the InChIKey of N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine?
The InChIKey is CEQWELFRGJQOCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4/c1-17(10-5-3-2-4-6-10)11-7-8-14-13-12(11)15-9-16-13/h2-9H,1H3,(H,14,15,16).
What are the key properties of N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine?
N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine has a molecular weight of 224.27 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-phenyl-1H-imidazo[4,5-b]pyridin-7-amine is sourced from PubChem (CID 67278158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).