N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide

C20H21FN2O3 — CID 139369052

IUPACN-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide
SMILESCOc1ccc(F)cc1OC1CC(C(=O)NN2CCc3ccccc32)C1
InChIInChI=1S/C20H21FN2O3/c1-25-18-7-6-15(21)12-19(18)26-16-10-14(11-16)20(24)22-23-9-8-13-4-2-3-5-17(13)23/h2-7,12,14,16H,8-11H2,1H3,(H,22,24)
InChIKeyFBVPZYKNMNHDOK-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.09
Rot. Bonds5

About N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide

N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide (PubChem CID 139369052) has the molecular formula C20H21FN2O3 and a molecular weight of 356.40 g/mol. Its IUPAC name is N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide
PubChem CID139369052
Molecular FormulaC20H21FN2O3
Molecular Weight356.40 g/mol
Exact Mass356.15
IUPAC NameN-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide
SMILESCOc1ccc(F)cc1OC1CC(C(=O)NN2CCc3ccccc32)C1
InChIInChI=1S/C20H21FN2O3/c1-25-18-7-6-15(21)12-19(18)26-16-10-14(11-16)20(24)22-23-9-8-13-4-2-3-5-17(13)23/h2-7,12,14,16H,8-11H2,1H3,(H,22,24)
InChIKeyFBVPZYKNMNHDOK-UHFFFAOYSA-N
XLogP3.09
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide 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

3-(5-fluoro-2-methoxyphenoxy)-N-methylcyclobutane-1-carboxamide
CID 139373831
methyl 3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxylate
CID 139373983
2,3-dihydroindol-1-ylurea
CID 22353227
2-(2,3-dihydroindol-1-yl)-1-(5-fluoro-2-methoxyphenyl)ethanone
CID 43228012
N-[1-(4-cyano-2-pyridinyl)azetidin-3-yl]-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide
CID 139369067
N-(3,4-dihydro-2H-quinolin-1-yl)cyclohexanecarboxamide
CID 5028392
N-[2-(4-cyano-2-pyridinyl)-2-azaspiro[3.3]heptan-6-yl]-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide
CID 139369125
3-[2-(difluoromethoxy)-5-fluorophenoxy]-N-(3-ethyl-3-methylcyclobutyl)cyclobutane-1-carboxamide
CID 142323295
3-(3-cyclopentyloxy-4-methoxyphenyl)sulfonyl-1-(3,4-dihydro-2H-quinolin-1-yl)pentan-1-one
CID 150365097
N-(4-acetyl-1,3-thiazol-2-yl)-3-[2-(difluoromethoxy)-5-fluorophenoxy]cyclobutane-1-carboxamide
CID 139369303
methyl 3-(2-chlorophenoxy)cyclobutane-1-carboxylate
CID 134430249
N-[1-(2,4-difluorophenyl)ethyl]-5-(2,3-dihydroindol-1-ylsulfonyl)-2-methoxybenzamide
CID 112763869

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide?
The IUPAC name of N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide (CID 139369052) is N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide.
What is the SMILES notation for N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide?
The canonical SMILES for N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide is COc1ccc(F)cc1OC1CC(C(=O)NN2CCc3ccccc32)C1.
What is the InChIKey of N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide?
The InChIKey is FBVPZYKNMNHDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O3/c1-25-18-7-6-15(21)12-19(18)26-16-10-14(11-16)20(24)22-23-9-8-13-4-2-3-5-17(13)23/h2-7,12,14,16H,8-11H2,1H3,(H,22,24).
What are the key properties of N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide?
N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide has a molecular weight of 356.40 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroindol-1-yl)-3-(5-fluoro-2-methoxyphenoxy)cyclobutane-1-carboxamide is sourced from PubChem (CID 139369052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).