N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide

C23H22F2N2O3 — CID 56561737

IUPACN-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
SMILESCC1Cc2ccccc2N1Cc1occc1C(=O)NCc1cccc(OC(F)F)c1
InChIInChI=1S/C23H22F2N2O3/c1-15-11-17-6-2-3-8-20(17)27(15)14-21-19(9-10-29-21)22(28)26-13-16-5-4-7-18(12-16)30-23(24)25/h2-10,12,15,23H,11,13-14H2,1H3,(H,26,28)
InChIKeyPODJVHPYWNBCNY-UHFFFAOYSA-N
MW412.44 g/mol
LogP4.76
Rot. Bonds7

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

N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide (PubChem CID 56561737) has the molecular formula C23H22F2N2O3 and a molecular weight of 412.44 g/mol. Its IUPAC name is N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
PubChem CID56561737
Molecular FormulaC23H22F2N2O3
Molecular Weight412.44 g/mol
Exact Mass412.16
IUPAC NameN-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
SMILESCC1Cc2ccccc2N1Cc1occc1C(=O)NCc1cccc(OC(F)F)c1
InChIInChI=1S/C23H22F2N2O3/c1-15-11-17-6-2-3-8-20(17)27(15)14-21-19(9-10-29-21)22(28)26-13-16-5-4-7-18(12-16)30-23(24)25/h2-10,12,15,23H,11,13-14H2,1H3,(H,26,28)
InChIKeyPODJVHPYWNBCNY-UHFFFAOYSA-N
XLogP4.76
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.44
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide with MolForge

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Related Compounds

N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
CID 56560988
N-[(2,5-dimethoxyphenyl)methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
CID 56560150
N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
CID 56560432
N-(3-aminobutyl)-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
CID 119496457
N-[(4-bromothiophen-2-yl)methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
CID 56565449
methyl 3-[[2-[[(2S)-2-methyl-2,3-dihydroindol-1-yl]methyl]furan-3-carbonyl]amino]propanoate
CID 95274797
N-[2-(methylamino)propyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
CID 120830812
2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-[(4-thiomorpholin-4-ylphenyl)methyl]furan-3-carboxamide
CID 56565419
N-[[4-(butanoylamino)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide
CID 56566955
2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-(4-methylpentyl)furan-3-carboxamide
CID 56567369
2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-N-pentylfuran-3-carboxamide
CID 56562145
(2R)-2-[[2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carbonyl]amino]propanoic acid
CID 119369916

Frequently Asked Questions

What is the IUPAC name of N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
The IUPAC name of N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide (CID 56561737) is N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide.
What is the SMILES notation for N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
The canonical SMILES for N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide is CC1Cc2ccccc2N1Cc1occc1C(=O)NCc1cccc(OC(F)F)c1.
What is the InChIKey of N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
The InChIKey is PODJVHPYWNBCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22F2N2O3/c1-15-11-17-6-2-3-8-20(17)27(15)14-21-19(9-10-29-21)22(28)26-13-16-5-4-7-18(12-16)30-23(24)25/h2-10,12,15,23H,11,13-14H2,1H3,(H,26,28).
What are the key properties of N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide?
N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide has a molecular weight of 412.44 g/mol, XLogP of 4.76, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(difluoromethoxy)phenyl]methyl]-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]furan-3-carboxamide is sourced from PubChem (CID 56561737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).