4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one

C15H15F3N6O2 — CID 56675929

IUPAC4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one
SMILESNc1nc(C(F)(F)F)cc2c1[nH]c(=O)n2Cc1ccc(NCCO)nc1
InChIInChI=1S/C15H15F3N6O2/c16-15(17,18)10-5-9-12(13(19)22-10)23-14(26)24(9)7-8-1-2-11(21-6-8)20-3-4-25/h1-2,5-6,25H,3-4,7H2,(H2,19,22)(H,20,21)(H,23,26)
InChIKeyREPUMJFPOCVVOM-UHFFFAOYSA-N
MW368.32 g/mol
LogP1.17
Rot. Bonds5

About 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one

4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one (PubChem CID 56675929) has the molecular formula C15H15F3N6O2 and a molecular weight of 368.32 g/mol. Its IUPAC name is 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one.

Molecular Properties

Compound Name4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one
PubChem CID56675929
Molecular FormulaC15H15F3N6O2
Molecular Weight368.32 g/mol
Exact Mass368.12
IUPAC Name4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one
SMILESNc1nc(C(F)(F)F)cc2c1[nH]c(=O)n2Cc1ccc(NCCO)nc1
InChIInChI=1S/C15H15F3N6O2/c16-15(17,18)10-5-9-12(13(19)22-10)23-14(26)24(9)7-8-1-2-11(21-6-8)20-3-4-25/h1-2,5-6,25H,3-4,7H2,(H2,19,22)(H,20,21)(H,23,26)
InChIKeyREPUMJFPOCVVOM-UHFFFAOYSA-N
XLogP1.17
TPSA121.85 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.32
LogP ≤ 51.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Analyze 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one?
The IUPAC name of 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one (CID 56675929) is 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one.
What is the SMILES notation for 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one?
The canonical SMILES for 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one is Nc1nc(C(F)(F)F)cc2c1[nH]c(=O)n2Cc1ccc(NCCO)nc1.
What is the InChIKey of 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one?
The InChIKey is REPUMJFPOCVVOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N6O2/c16-15(17,18)10-5-9-12(13(19)22-10)23-14(26)24(9)7-8-1-2-11(21-6-8)20-3-4-25/h1-2,5-6,25H,3-4,7H2,(H2,19,22)(H,20,21)(H,23,26).
What are the key properties of 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one?
4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one has a molecular weight of 368.32 g/mol, XLogP of 1.17, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-[[6-(2-hydroxyethylamino)-3-pyridinyl]methyl]-6-(trifluoromethyl)-3H-imidazo[4,5-c]pyridin-2-one is sourced from PubChem (CID 56675929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).