(2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol

C15H23FN4O — CID 10424529

IUPAC(2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol
SMILESCCCCCC[C@H]([C@@H](O)CF)n1cnc2c(N)nccc21
InChIInChI=1S/C15H23FN4O/c1-2-3-4-5-6-11(13(21)9-16)20-10-19-14-12(20)7-8-18-15(14)17/h7-8,10-11,13,21H,2-6,9H2,1H3,(H2,17,18)/t11-,13+/m1/s1
InChIKeyTULJLYBRHAOBQC-YPMHNXCESA-N
MW294.37 g/mol
LogP2.86
Rot. Bonds8

About (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol

(2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol (PubChem CID 10424529) has the molecular formula C15H23FN4O and a molecular weight of 294.37 g/mol. Its IUPAC name is (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol.

Molecular Properties

Compound Name(2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol
PubChem CID10424529
Molecular FormulaC15H23FN4O
Molecular Weight294.37 g/mol
Exact Mass294.19
IUPAC Name(2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol
SMILESCCCCCC[C@H]([C@@H](O)CF)n1cnc2c(N)nccc21
InChIInChI=1S/C15H23FN4O/c1-2-3-4-5-6-11(13(21)9-16)20-10-19-14-12(20)7-8-18-15(14)17/h7-8,10-11,13,21H,2-6,9H2,1H3,(H2,17,18)/t11-,13+/m1/s1
InChIKeyTULJLYBRHAOBQC-YPMHNXCESA-N
XLogP2.86
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol with MolForge

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

Launch Full Analysis

Related Compounds

1-(1-aminobutyl)imidazo[4,5-c]pyridin-4-amine
CID 166965124
5-amino-1-(2-hydroxynonan-3-yl)imidazole-4-carboxamide;hydrochloride
CID 70515812
(2S,3S)-3-(6-aminopurin-9-yl)hexan-2-ol
CID 67145035
9-(1-aminopentyl)purin-6-amine
CID 174938588
1-octan-3-ylbenzimidazole
CID 57027329
9-[(2S,3R)-2-[tert-butyl(dimethyl)silyl]oxyoctan-3-yl]purin-6-amine
CID 67145030
aniline;hexane-1,1-diol
CID 174683657
(Z)-5-(4-aminoimidazo[4,5-c]pyridin-1-yl)pent-3-ene-1,2-diol
CID 82371988
2-amino-3-fluoro-N-heptan-2-ylpyridine-4-carboxamide
CID 105385875
4-chloro-1-[(1R)-1-[(4R)-2-ethoxy-1,3-dioxolan-4-yl]heptyl]imidazo[4,5-c]pyridine
CID 10384371
(2S,3R)-3-(1,2,4-triazol-4-yl)nonan-2-ol
CID 10036067
1-(4-methyl-2-pyridinyl)tridecan-1-ol
CID 63840083

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol?
The IUPAC name of (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol (CID 10424529) is (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol.
What is the SMILES notation for (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol?
The canonical SMILES for (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol is CCCCCC[C@H]([C@@H](O)CF)n1cnc2c(N)nccc21.
What is the InChIKey of (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol?
The InChIKey is TULJLYBRHAOBQC-YPMHNXCESA-N. The full InChI is InChI=1S/C15H23FN4O/c1-2-3-4-5-6-11(13(21)9-16)20-10-19-14-12(20)7-8-18-15(14)17/h7-8,10-11,13,21H,2-6,9H2,1H3,(H2,17,18)/t11-,13+/m1/s1.
What are the key properties of (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol?
(2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol has a molecular weight of 294.37 g/mol, XLogP of 2.86, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-3-(4-aminoimidazo[4,5-c]pyridin-1-yl)-1-fluorononan-2-ol is sourced from PubChem (CID 10424529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).