N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide

C18H19ClN2O2 — CID 4875488

IUPACN-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)N1CCc2ccccc21
InChIInChI=1S/C18H19ClN2O2/c1-12(21-10-9-13-5-3-4-6-16(13)21)18(22)20-15-11-14(19)7-8-17(15)23-2/h3-8,11-12H,9-10H2,1-2H3,(H,20,22)
InChIKeyZXHHVALBTTZKNZ-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.74
Rot. Bonds4

About N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide

N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide (PubChem CID 4875488) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide
PubChem CID4875488
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)N1CCc2ccccc21
InChIInChI=1S/C18H19ClN2O2/c1-12(21-10-9-13-5-3-4-6-16(13)21)18(22)20-15-11-14(19)7-8-17(15)23-2/h3-8,11-12H,9-10H2,1-2H3,(H,20,22)
InChIKeyZXHHVALBTTZKNZ-UHFFFAOYSA-N
XLogP3.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.82
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(4-chloro-2-fluorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 9432138
(2S)-2-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-methoxy-5-methylphenyl)propanamide
CID 9249767
1-(5-chloro-2-methoxyphenyl)-3-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]urea
CID 92881462
1-(5-chloro-2-methoxyphenyl)-3-[1-(2,3-dihydroindol-1-yl)-3-methyl-1-oxobutan-2-yl]urea
CID 46383367
(2R)-N-(3-chlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 8704432
(2S)-2-(2,3-dihydroindol-1-yl)-N-(2-fluorophenyl)propanamide
CID 8704291
(2R)-N-(2,3-dichlorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 7940820
1-(5-chloro-2-methoxyphenyl)-3-[(2S)-2-(2,3-dihydroindol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]urea
CID 30294579
1-(5-chloro-2-methoxyphenyl)-3-[2-(2,3-dihydroindol-1-yl)-2-[4-(dimethylamino)phenyl]ethyl]urea
CID 43956436
1-(5-chloro-2-methoxyphenyl)-3-[(1S)-2-(2,3-dihydroindol-1-yl)-2-oxo-1-phenylethyl]urea
CID 92881593
N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide
CID 109034841
N-(3-amino-4-fluorophenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 16792940

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide (CID 4875488) is N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide is COc1ccc(Cl)cc1NC(=O)C(C)N1CCc2ccccc21.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
The InChIKey is ZXHHVALBTTZKNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-12(21-10-9-13-5-3-4-6-16(13)21)18(22)20-15-11-14(19)7-8-17(15)23-2/h3-8,11-12H,9-10H2,1-2H3,(H,20,22).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide?
N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide has a molecular weight of 330.82 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide is sourced from PubChem (CID 4875488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).