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

C20H24FN3O4 — CID 143636209

IUPACethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide
SMILESCC.Cc1ccc(Nc2c(C(=O)NOCC(C)O)oc3ccncc23)c(F)c1
InChIInChI=1S/C18H18FN3O4.C2H6/c1-10-3-4-14(13(19)7-10)21-16-12-8-20-6-5-15(12)26-17(16)18(24)22-25-9-11(2)23;1-2/h3-8,11,21,23H,9H2,1-2H3,(H,22,24);1-2H3
InChIKeyQWFXTJSEILIESE-UHFFFAOYSA-N
MW389.43 g/mol
LogP4.09
Rot. Bonds6

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

ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide (PubChem CID 143636209) has the molecular formula C20H24FN3O4 and a molecular weight of 389.43 g/mol. Its IUPAC name is ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide.

Molecular Properties

Compound Nameethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide
PubChem CID143636209
Molecular FormulaC20H24FN3O4
Molecular Weight389.43 g/mol
Exact Mass389.18
IUPAC Nameethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide
SMILESCC.Cc1ccc(Nc2c(C(=O)NOCC(C)O)oc3ccncc23)c(F)c1
InChIInChI=1S/C18H18FN3O4.C2H6/c1-10-3-4-14(13(19)7-10)21-16-12-8-20-6-5-15(12)26-17(16)18(24)22-25-9-11(2)23;1-2/h3-8,11,21,23H,9H2,1-2H3,(H,22,24);1-2H3
InChIKeyQWFXTJSEILIESE-UHFFFAOYSA-N
XLogP4.09
TPSA96.62 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.43
LogP ≤ 54.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(2,3-dihydroxypropyl)-3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;ethane
CID 143636219
ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxyethyl)furo[3,2-c]pyridine-2-carboxamide
CID 143636022
ethane;3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridine-2-carboxamide;2-methylpropane-1,2-diol
CID 143636167
3-(4-bromo-2-fluoroanilino)-N-(2-hydroxyethoxy)furo[3,2-c]pyridine-2-carboxamide
CID 25013474
3-(2-fluoro-4-iodoanilino)-N-phenylmethoxyfuro[3,2-c]pyridine-2-carboxamide
CID 25013801
[3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridin-2-yl]-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 143636066
4-(2-fluoro-4-methylanilino)-N-[(2S)-2-hydroxypropoxy]-1H-pyrazolo[3,4-b]pyridine-5-carboxamide
CID 143922222
3-(2,5-difluoro-4-iodoanilino)-N-(3-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide
CID 88885981
ethane;[3-(2-fluoro-4-methylanilino)furo[3,2-c]pyridin-2-yl]-(3-hydroxypiperidin-1-yl)methanone
CID 143636055
3-(2,5-difluoro-4-iodoanilino)-N-[[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methoxy]furo[3,2-c]pyridine-2-carboxamide
CID 59704573
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

Frequently Asked Questions

What is the IUPAC name of ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide?
The IUPAC name of ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide (CID 143636209) is ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide.
What is the SMILES notation for ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide?
The canonical SMILES for ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide is CC.Cc1ccc(Nc2c(C(=O)NOCC(C)O)oc3ccncc23)c(F)c1.
What is the InChIKey of ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide?
The InChIKey is QWFXTJSEILIESE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FN3O4.C2H6/c1-10-3-4-14(13(19)7-10)21-16-12-8-20-6-5-15(12)26-17(16)18(24)22-25-9-11(2)23;1-2/h3-8,11,21,23H,9H2,1-2H3,(H,22,24);1-2H3.
What are the key properties of ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide?
ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide has a molecular weight of 389.43 g/mol, XLogP of 4.09, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-(2-fluoro-4-methylanilino)-N-(2-hydroxypropoxy)furo[3,2-c]pyridine-2-carboxamide is sourced from PubChem (CID 143636209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).