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

C12H18N4O — CID 86803424

IUPAC2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol
SMILESCCN(CCO)Cc1nc2nccc(C)c2[nH]1
InChIInChI=1S/C12H18N4O/c1-3-16(6-7-17)8-10-14-11-9(2)4-5-13-12(11)15-10/h4-5,17H,3,6-8H2,1-2H3,(H,13,14,15)
InChIKeyLRWKJMLSIDKYGS-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.08
Rot. Bonds5

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

2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol (PubChem CID 86803424) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol
PubChem CID86803424
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol
SMILESCCN(CCO)Cc1nc2nccc(C)c2[nH]1
InChIInChI=1S/C12H18N4O/c1-3-16(6-7-17)8-10-14-11-9(2)4-5-13-12(11)15-10/h4-5,17H,3,6-8H2,1-2H3,(H,13,14,15)
InChIKeyLRWKJMLSIDKYGS-UHFFFAOYSA-N
XLogP1.08
TPSA65.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol?
The IUPAC name of 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol (CID 86803424) is 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol is CCN(CCO)Cc1nc2nccc(C)c2[nH]1.
What is the InChIKey of 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol?
The InChIKey is LRWKJMLSIDKYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-3-16(6-7-17)8-10-14-11-9(2)4-5-13-12(11)15-10/h4-5,17H,3,6-8H2,1-2H3,(H,13,14,15).
What are the key properties of 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol?
2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol has a molecular weight of 234.30 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[(7-methyl-1H-imidazo[4,5-b]pyridin-2-yl)methyl]amino]ethanol is sourced from PubChem (CID 86803424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).