4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol

C15H16N4O — CID 63723821

IUPAC4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol
SMILESCc1ccnc2nc(C(N)Cc3ccc(O)cc3)[nH]c12
InChIInChI=1S/C15H16N4O/c1-9-6-7-17-15-13(9)18-14(19-15)12(16)8-10-2-4-11(20)5-3-10/h2-7,12,20H,8,16H2,1H3,(H,17,18,19)
InChIKeyMFRYXGXAJPQAOU-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.21
Rot. Bonds3

About 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol

4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol (PubChem CID 63723821) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol.

Molecular Properties

Compound Name4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol
PubChem CID63723821
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol
SMILESCc1ccnc2nc(C(N)Cc3ccc(O)cc3)[nH]c12
InChIInChI=1S/C15H16N4O/c1-9-6-7-17-15-13(9)18-14(19-15)12(16)8-10-2-4-11(20)5-3-10/h2-7,12,20H,8,16H2,1H3,(H,17,18,19)
InChIKeyMFRYXGXAJPQAOU-UHFFFAOYSA-N
XLogP2.21
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol?
The IUPAC name of 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol (CID 63723821) is 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol.
What is the SMILES notation for 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol?
The canonical SMILES for 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol is Cc1ccnc2nc(C(N)Cc3ccc(O)cc3)[nH]c12.
What is the InChIKey of 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol?
The InChIKey is MFRYXGXAJPQAOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-9-6-7-17-15-13(9)18-14(19-15)12(16)8-10-2-4-11(20)5-3-10/h2-7,12,20H,8,16H2,1H3,(H,17,18,19).
What are the key properties of 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol?
4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol has a molecular weight of 268.32 g/mol, XLogP of 2.21, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-amino-2-(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]phenol is sourced from PubChem (CID 63723821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).