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

C14H15N5O — CID 79815748

IUPAC2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol
SMILESCN(C)c1ccc2[nH]c(-c3ccc(N)c(O)c3)nc2n1
InChIInChI=1S/C14H15N5O/c1-19(2)12-6-5-10-14(17-12)18-13(16-10)8-3-4-9(15)11(20)7-8/h3-7,20H,15H2,1-2H3,(H,16,17,18)
InChIKeySYFVFSSGJCLCJH-UHFFFAOYSA-N
MW269.31 g/mol
LogP1.98
Rot. Bonds2

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

2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol (PubChem CID 79815748) has the molecular formula C14H15N5O and a molecular weight of 269.31 g/mol. Its IUPAC name is 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol.

Molecular Properties

Compound Name2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol
PubChem CID79815748
Molecular FormulaC14H15N5O
Molecular Weight269.31 g/mol
Exact Mass269.13
IUPAC Name2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol
SMILESCN(C)c1ccc2[nH]c(-c3ccc(N)c(O)c3)nc2n1
InChIInChI=1S/C14H15N5O/c1-19(2)12-6-5-10-14(17-12)18-13(16-10)8-3-4-9(15)11(20)7-8/h3-7,20H,15H2,1-2H3,(H,16,17,18)
InChIKeySYFVFSSGJCLCJH-UHFFFAOYSA-N
XLogP1.98
TPSA91.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol?
The IUPAC name of 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol (CID 79815748) is 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol.
What is the SMILES notation for 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol?
The canonical SMILES for 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol is CN(C)c1ccc2[nH]c(-c3ccc(N)c(O)c3)nc2n1.
What is the InChIKey of 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol?
The InChIKey is SYFVFSSGJCLCJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O/c1-19(2)12-6-5-10-14(17-12)18-13(16-10)8-3-4-9(15)11(20)7-8/h3-7,20H,15H2,1-2H3,(H,16,17,18).
What are the key properties of 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol?
2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol has a molecular weight of 269.31 g/mol, XLogP of 1.98, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[5-(dimethylamino)-1H-imidazo[4,5-b]pyridin-2-yl]phenol is sourced from PubChem (CID 79815748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).