3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol

C19H18FN3O4 — CID 143636140

IUPAC3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol
SMILESC#Cc1ccc(Nc2c(C(N)=O)oc3ccncc23)c(F)c1.OCCCO
InChIInChI=1S/C16H10FN3O2.C3H8O2/c1-2-9-3-4-12(11(17)7-9)20-14-10-8-19-6-5-13(10)22-15(14)16(18)21;4-2-1-3-5/h1,3-8,20H,(H2,18,21);4-5H,1-3H2
InChIKeyJFHWUXLBGHAMBU-UHFFFAOYSA-N
MW371.37 g/mol
LogP2.15
Rot. Bonds5

About 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol

3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol (PubChem CID 143636140) has the molecular formula C19H18FN3O4 and a molecular weight of 371.37 g/mol. Its IUPAC name is 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol.

Molecular Properties

Compound Name3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol
PubChem CID143636140
Molecular FormulaC19H18FN3O4
Molecular Weight371.37 g/mol
Exact Mass371.13
IUPAC Name3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol
SMILESC#Cc1ccc(Nc2c(C(N)=O)oc3ccncc23)c(F)c1.OCCCO
InChIInChI=1S/C16H10FN3O2.C3H8O2/c1-2-9-3-4-12(11(17)7-9)20-14-10-8-19-6-5-13(10)22-15(14)16(18)21;4-2-1-3-5/h1,3-8,20H,(H2,18,21);4-5H,1-3H2
InChIKeyJFHWUXLBGHAMBU-UHFFFAOYSA-N
XLogP2.15
TPSA121.61 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.37
LogP ≤ 52.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol 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

ethane;3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;2-methylpropane-1,2-diol
CID 143636167
3-(2-fluoro-4-iodoanilino)-N-(3-hydroxypropyl)-N-methylfuro[3,2-c]pyridine-2-carboxamide
CID 59704658
3-(4-bromo-2-fluoroanilino)-N-(2-hydroxyethoxy)furo[3,2-c]pyridine-2-carboxamide
CID 25013474
ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxyethyl)furo[3,2-c]pyridine-2-carboxamide
CID 143636022
3-(2,5-difluoro-4-iodoanilino)-N-(3-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide
CID 88885981
ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide
CID 143636209
N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane
CID 143636219
3-(4-bromo-2,5-difluoroanilino)furo[3,2-c]pyridine-2-carboxylic acid
CID 151410687
3-(4-methylanilino)furo[3,2-c]pyridine-2-carboxamide
CID 143636123
3-(4-iodoanilino)furo[3,2-c]pyridine-2-carboxamide
CID 154558318
3-(2-fluoro-4-iodoanilino)-N-phenylmethoxyfuro[3,2-c]pyridine-2-carboxamide
CID 25013801
CID 88885978
CID 88885978

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol?
The IUPAC name of 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol (CID 143636140) is 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol.
What is the SMILES notation for 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol?
The canonical SMILES for 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol is C#Cc1ccc(Nc2c(C(N)=O)oc3ccncc23)c(F)c1.OCCCO.
What is the InChIKey of 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol?
The InChIKey is JFHWUXLBGHAMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN3O2.C3H8O2/c1-2-9-3-4-12(11(17)7-9)20-14-10-8-19-6-5-13(10)22-15(14)16(18)21;4-2-1-3-5/h1,3-8,20H,(H2,18,21);4-5H,1-3H2.
What are the key properties of 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol?
3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol has a molecular weight of 371.37 g/mol, XLogP of 2.15, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol is sourced from PubChem (CID 143636140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).