N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide

C24H25FN2O3 — CID 56560130

IUPACN-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
SMILESCC1Cc2ccccc2N1Cc1occc1C(=O)N(C)CCOc1ccccc1F
InChIInChI=1S/C24H25FN2O3/c1-17-15-18-7-3-5-9-21(18)27(17)16-23-19(11-13-29-23)24(28)26(2)12-14-30-22-10-6-4-8-20(22)25/h3-11,13,17H,12,14-16H2,1-2H3
InChIKeyQNZLWZDYTNTONW-UHFFFAOYSA-N
MW408.47 g/mol
LogP4.52
Rot. Bonds7

About N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide

N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide (PubChem CID 56560130) has the molecular formula C24H25FN2O3 and a molecular weight of 408.47 g/mol. Its IUPAC name is N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
PubChem CID56560130
Molecular FormulaC24H25FN2O3
Molecular Weight408.47 g/mol
Exact Mass408.18
IUPAC NameN-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
SMILESCC1Cc2ccccc2N1Cc1occc1C(=O)N(C)CCOc1ccccc1F
InChIInChI=1S/C24H25FN2O3/c1-17-15-18-7-3-5-9-21(18)27(17)16-23-19(11-13-29-23)24(28)26(2)12-14-30-22-10-6-4-8-20(22)25/h3-11,13,17H,12,14-16H2,1-2H3
InChIKeyQNZLWZDYTNTONW-UHFFFAOYSA-N
XLogP4.52
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.47
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
The IUPAC name of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide (CID 56560130) is N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide is CC1Cc2ccccc2N1Cc1occc1C(=O)N(C)CCOc1ccccc1F.
What is the InChIKey of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
The InChIKey is QNZLWZDYTNTONW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN2O3/c1-17-15-18-7-3-5-9-21(18)27(17)16-23-19(11-13-29-23)24(28)26(2)12-14-30-22-10-6-4-8-20(22)25/h3-11,13,17H,12,14-16H2,1-2H3.
What are the key properties of N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide has a molecular weight of 408.47 g/mol, XLogP of 4.52, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenoxy)ethyl]-N-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide is sourced from PubChem (CID 56560130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).