3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol

C19H26N4O2 — CID 162667050

IUPAC3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol
SMILESCCCCCn1c(-c2ccco2)nc2c(N(C)CCCO)nccc21
InChIInChI=1S/C19H26N4O2/c1-3-4-5-12-23-15-9-10-20-19(22(2)11-7-13-24)17(15)21-18(23)16-8-6-14-25-16/h6,8-10,14,24H,3-5,7,11-13H2,1-2H3
InChIKeyFXTXXZMNWIDRNU-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.70
Rot. Bonds9

About 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol

3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol (PubChem CID 162667050) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol.

Molecular Properties

Compound Name3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol
PubChem CID162667050
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol
SMILESCCCCCn1c(-c2ccco2)nc2c(N(C)CCCO)nccc21
InChIInChI=1S/C19H26N4O2/c1-3-4-5-12-23-15-9-10-20-19(22(2)11-7-13-24)17(15)21-18(23)16-8-6-14-25-16/h6,8-10,14,24H,3-5,7,11-13H2,1-2H3
InChIKeyFXTXXZMNWIDRNU-UHFFFAOYSA-N
XLogP3.70
TPSA67.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol with MolForge

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Related Compounds

Kinetin riboside
CID 20345
Noberastine
CID 60531
8-(Furan-2-yl)-3-[2-[4-(5-methyl-2-pyridinyl)piperazin-1-yl]ethyl]-[1,2,4]triazolo[5,1-f]purin-5-amine
CID 10203891
1-[2-[6-Amino-8-(furan-2-yl)-9-prop-2-ynylpurin-2-yl]ethynyl]cyclohexan-1-ol
CID 89805044
6-Furfurylaminopurine riboside
CID 3832
N-(furan-2-ylmethyl)-9-methylpurin-6-amine
CID 221107
2-Furan-2-yl-1-furan-2-ylmethyl-1H-benzoimidazole
CID 650866
1-Methyl-2-(5-methyl-2-furanyl)-1H-benzimidazole
CID 806167
kinetin-9-N-glucoside
CID 25203435
Barmastine
CID 71300
6-Furan-2-yl-9-phenyl-9H-purin-2-ylamine
CID 44401937
6-(furan-2-yl)-5H-pyrrolo[2,3-b]pyrazine
CID 6538801

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol?
The IUPAC name of 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol (CID 162667050) is 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol.
What is the SMILES notation for 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol?
The canonical SMILES for 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol is CCCCCn1c(-c2ccco2)nc2c(N(C)CCCO)nccc21.
What is the InChIKey of 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol?
The InChIKey is FXTXXZMNWIDRNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-3-4-5-12-23-15-9-10-20-19(22(2)11-7-13-24)17(15)21-18(23)16-8-6-14-25-16/h6,8-10,14,24H,3-5,7,11-13H2,1-2H3.
What are the key properties of 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol?
3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol has a molecular weight of 342.44 g/mol, XLogP of 3.70, 9 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(furan-2-yl)-1-pentylimidazo[4,5-c]pyridin-4-yl]-methylamino]propan-1-ol is sourced from PubChem (CID 162667050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).