N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide

C23H19FN2O3 — CID 171037338

IUPACN-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(C[C@H]3C(=O)Nc4ccc(F)cc43)c2)cc1
InChIInChI=1S/C23H19FN2O3/c1-29-18-8-5-15(6-9-18)22(27)25-17-4-2-3-14(11-17)12-20-19-13-16(24)7-10-21(19)26-23(20)28/h2-11,13,20H,12H2,1H3,(H,25,27)(H,26,28)/t20-/m1/s1
InChIKeyPMXAOPMAOYNZJP-HXUWFJFHSA-N
MW390.41 g/mol
LogP4.36
Rot. Bonds5

About N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide

N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide (PubChem CID 171037338) has the molecular formula C23H19FN2O3 and a molecular weight of 390.41 g/mol. Its IUPAC name is N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide.

Molecular Properties

Compound NameN-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide
PubChem CID171037338
Molecular FormulaC23H19FN2O3
Molecular Weight390.41 g/mol
Exact Mass390.14
IUPAC NameN-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cccc(C[C@H]3C(=O)Nc4ccc(F)cc43)c2)cc1
InChIInChI=1S/C23H19FN2O3/c1-29-18-8-5-15(6-9-18)22(27)25-17-4-2-3-14(11-17)12-20-19-13-16(24)7-10-21(19)26-23(20)28/h2-11,13,20H,12H2,1H3,(H,25,27)(H,26,28)/t20-/m1/s1
InChIKeyPMXAOPMAOYNZJP-HXUWFJFHSA-N
XLogP4.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.41
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[[(2,2-dimethyl-6-oxopiperidin-3-yl)amino]methyl]phenyl]-4-methoxybenzamide
CID 126838073
4-fluoro-N-[3-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanylphenyl]benzamide
CID 19299599
(3-fluorophenyl)methyl-[2-[4-[(4-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl]-methylazanium
CID 8961817
N-[(4-fluorophenyl)methyl]-4-[(4-methoxybenzoyl)amino]benzamide
CID 87005885
4-fluoro-N-[3-[[(3-methoxy-4-methylphenyl)methylamino]methyl]phenyl]benzamide
CID 119050090
(3-fluorophenyl)methyl 4-[(4-methoxybenzoyl)amino]benzoate
CID 2224729
1-N-benzyl-4-N-(3-methoxyphenyl)benzene-1,4-dicarboxamide
CID 109046735
N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)benzamide
CID 110405864
2-[(4-fluorophenyl)methylsulfanylmethyl]-N-[(3-methoxyphenyl)methyl]-3-oxo-2,4-dihydro-1H-quinoxaline-6-carboxamide
CID 20970650
ethyl [4-[[3-[(4-fluorobenzoyl)amino]phenyl]carbamoyl]phenyl] carbonate
CID 108930745
1-N-(4-fluorophenyl)-3-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057463
4-(aminomethyl)-N-(3-methoxyphenyl)benzamide
CID 16796099

Frequently Asked Questions

What is the IUPAC name of N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide?
The IUPAC name of N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide (CID 171037338) is N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide.
What is the SMILES notation for N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide?
The canonical SMILES for N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide is COc1ccc(C(=O)Nc2cccc(C[C@H]3C(=O)Nc4ccc(F)cc43)c2)cc1.
What is the InChIKey of N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide?
The InChIKey is PMXAOPMAOYNZJP-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H19FN2O3/c1-29-18-8-5-15(6-9-18)22(27)25-17-4-2-3-14(11-17)12-20-19-13-16(24)7-10-21(19)26-23(20)28/h2-11,13,20H,12H2,1H3,(H,25,27)(H,26,28)/t20-/m1/s1.
What are the key properties of N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide?
N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide has a molecular weight of 390.41 g/mol, XLogP of 4.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[(3R)-5-fluoro-2-oxo-1,3-dihydroindol-3-yl]methyl]phenyl]-4-methoxybenzamide is sourced from PubChem (CID 171037338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).