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

C18H19ClN2O2 — CID 109034841

IUPACN-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCN1CCc2ccccc21
InChIInChI=1S/C18H19ClN2O2/c1-23-17-7-6-14(19)12-15(17)20-18(22)9-11-21-10-8-13-4-2-3-5-16(13)21/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyLOSBMBUJXLRKQJ-UHFFFAOYSA-N
MW330.82 g/mol
LogP3.74
Rot. Bonds5

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

N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide (PubChem CID 109034841) has the molecular formula C18H19ClN2O2 and a molecular weight of 330.82 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide
PubChem CID109034841
Molecular FormulaC18H19ClN2O2
Molecular Weight330.82 g/mol
Exact Mass330.11
IUPAC NameN-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)CCN1CCc2ccccc21
InChIInChI=1S/C18H19ClN2O2/c1-23-17-7-6-14(19)12-15(17)20-18(22)9-11-21-10-8-13-4-2-3-5-16(13)21/h2-7,12H,8-11H2,1H3,(H,20,22)
InChIKeyLOSBMBUJXLRKQJ-UHFFFAOYSA-N
XLogP3.74
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
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

N-(5-chloro-2-methylphenyl)-3-(2,3-dihydroindol-1-yl)propanamide
CID 109034835
N-(4-chloro-2,5-dimethoxyphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 22199888
3-(2,3-dihydroindol-1-yl)-N-(2-propan-2-yloxyphenyl)propanamide
CID 109034849
N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 4875488
1-(5-chloro-2-methoxyphenyl)-3-[1-(2,3-dihydroindol-1-yl)-3-methyl-1-oxobutan-2-yl]urea
CID 46383367
N-(3-chloro-4-methylphenyl)-3-(2,3-dihydroindol-1-yl)propanamide
CID 109034837
(3S)-2-[3-(5-chloro-2-methoxyanilino)-3-oxopropyl]-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 55936092
N-(5-chloro-2-methoxyphenyl)-2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 3302526
N-(5-chloro-2-methoxyphenyl)-2-[(2R)-2-methyl-2,3-dihydroindol-1-yl]acetamide
CID 7940760
1-(5-chloro-2-methoxyphenyl)-3-[(2S)-1-(2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]urea
CID 92881462
N-(4-chloro-2-methylphenyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 109007270
3-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-fluorophenyl)propanamide
CID 24588519

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide (CID 109034841) is N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide is COc1ccc(Cl)cc1NC(=O)CCN1CCc2ccccc21.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide?
The InChIKey is LOSBMBUJXLRKQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19ClN2O2/c1-23-17-7-6-14(19)12-15(17)20-18(22)9-11-21-10-8-13-4-2-3-5-16(13)21/h2-7,12H,8-11H2,1H3,(H,20,22).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide?
N-(5-chloro-2-methoxyphenyl)-3-(2,3-dihydroindol-1-yl)propanamide has a molecular weight of 330.82 g/mol, XLogP of 3.74, 5 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)-3-(2,3-dihydroindol-1-yl)propanamide is sourced from PubChem (CID 109034841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).