N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane

C20H24FN3O4 — CID 143636219

IUPACN-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane
SMILESCC.Cc1ccc(Nc2c(C(=O)NCC(O)CO)oc3ccncc23)c(F)c1
InChIInChI=1S/C18H18FN3O4.C2H6/c1-10-2-3-14(13(19)6-10)22-16-12-8-20-5-4-15(12)26-17(16)18(25)21-7-11(24)9-23;1-2/h2-6,8,11,22-24H,7,9H2,1H3,(H,21,25);1-2H3
InChIKeyBLVQGEUKGOFBBW-UHFFFAOYSA-N
MW389.43 g/mol
LogP3.13
Rot. Bonds6

About N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane

N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane (PubChem CID 143636219) has the molecular formula C20H24FN3O4 and a molecular weight of 389.43 g/mol. Its IUPAC name is N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane.

Molecular Properties

Compound NameN-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane
PubChem CID143636219
Molecular FormulaC20H24FN3O4
Molecular Weight389.43 g/mol
Exact Mass389.18
IUPAC NameN-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane
SMILESCC.Cc1ccc(Nc2c(C(=O)NCC(O)CO)oc3ccncc23)c(F)c1
InChIInChI=1S/C18H18FN3O4.C2H6/c1-10-2-3-14(13(19)6-10)22-16-12-8-20-5-4-15(12)26-17(16)18(25)21-7-11(24)9-23;1-2/h2-6,8,11,22-24H,7,9H2,1H3,(H,21,25);1-2H3
InChIKeyBLVQGEUKGOFBBW-UHFFFAOYSA-N
XLogP3.13
TPSA107.62 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.43
LogP ≤ 53.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane with MolForge

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Related Compounds

ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxyethyl)furo[3,2-c]pyridine-2-carboxamide
CID 143636022
ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide
CID 143636209
ethane;3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;2-methylpropane-1,2-diol
CID 143636167
[3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridin-2-yl]-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 143636066
ethane;[3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridin-2-yl]-(3-hydroxypiperidin-1-yl)methanone
CID 143636055
3-(4-bromo-2-fluoroanilino)-N-(2-hydroxyethoxy)furo[3,2-c]pyridine-2-carboxamide
CID 25013474
3-(2-fluoro-4-iodoanilino)-N-(3-hydroxypropyl)-N-methylfuro[3,2-c]pyridine-2-carboxamide
CID 59704658
ethyl 3-(2-chloro-4-methylanilino)furo[3,2-c]pyridine-2-carboxylate
CID 143636100
N-(azetidin-3-yloxy)-3-(2-fluoro-4-iodoanilino)furo[3,2-c]pyridine-2-carboxamide
CID 25013799
CID 88885978
CID 88885978
3-(2-fluoro-4-iodoanilino)-N-phenylmethoxyfuro[3,2-c]pyridine-2-carboxamide
CID 25013801
3-(4-ethynyl-2-fluoroanilino)furo[3,2-c]pyridine-2-carboxamide;propane-1,3-diol
CID 143636140

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane?
The IUPAC name of N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane (CID 143636219) is N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane.
What is the SMILES notation for N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane?
The canonical SMILES for N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane is CC.Cc1ccc(Nc2c(C(=O)NCC(O)CO)oc3ccncc23)c(F)c1.
What is the InChIKey of N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane?
The InChIKey is BLVQGEUKGOFBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3O4.C2H6/c1-10-2-3-14(13(19)6-10)22-16-12-8-20-5-4-15(12)26-17(16)18(25)21-7-11(24)9-23;1-2/h2-6,8,11,22-24H,7,9H2,1H3,(H,21,25);1-2H3.
What are the key properties of N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane?
N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane has a molecular weight of 389.43 g/mol, XLogP of 3.13, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane is sourced from PubChem (CID 143636219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).