N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide

C19H21ClN2O2 — CID 42887654

IUPACN-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)NC1CCc2ccccc21
InChIInChI=1S/C19H21ClN2O2/c1-12(21-16-9-7-13-5-3-4-6-15(13)16)19(23)22-17-11-14(20)8-10-18(17)24-2/h3-6,8,10-12,16,21H,7,9H2,1-2H3,(H,22,23)
InChIKeyULCSOXXQGPXUKG-UHFFFAOYSA-N
MW344.84 g/mol
LogP3.95
Rot. Bonds5

About N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide

N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide (PubChem CID 42887654) has the molecular formula C19H21ClN2O2 and a molecular weight of 344.84 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
PubChem CID42887654
Molecular FormulaC19H21ClN2O2
Molecular Weight344.84 g/mol
Exact Mass344.13
IUPAC NameN-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
SMILESCOc1ccc(Cl)cc1NC(=O)C(C)NC1CCc2ccccc21
InChIInChI=1S/C19H21ClN2O2/c1-12(21-16-9-7-13-5-3-4-6-15(13)16)19(23)22-17-11-14(20)8-10-18(17)24-2/h3-6,8,10-12,16,21H,7,9H2,1-2H3,(H,22,23)
InChIKeyULCSOXXQGPXUKG-UHFFFAOYSA-N
XLogP3.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dihydro-1H-inden-1-ylamino)-N-(2-methoxyphenyl)propanamide
CID 42926288
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
CID 42926295
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(cyclooctylamino)propanamide
CID 7509630
(2R)-N-(5-chloro-2-methoxyphenyl)-2-(cyclohexylamino)propanamide
CID 40602408
methyl 2-(2,3-dihydro-1H-inden-1-ylamino)propanoate
CID 60780698
(2S)-N-(5-chloro-2-methoxyphenyl)-2-[[(1R)-1-(2-methoxyphenyl)ethyl]amino]propanamide
CID 7590323
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide
CID 42883500
N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydroindol-1-yl)propanamide
CID 4875488
N-(5-chloro-2-methoxyphenyl)-2-[methyl-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]acetamide
CID 9261077
2-[(5-chloro-2,3-dihydro-1H-inden-1-yl)amino]propanamide
CID 81302223
(2S)-N-(5-chloro-2-methoxyphenyl)-2-(4,5-dimethoxy-2-methylanilino)propanamide
CID 30376996
3-(5-chloro-2-methoxyanilino)-2-methyl-3-oxopropanoic acid
CID 83550581

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide (CID 42887654) is N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide is COc1ccc(Cl)cc1NC(=O)C(C)NC1CCc2ccccc21.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
The InChIKey is ULCSOXXQGPXUKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O2/c1-12(21-16-9-7-13-5-3-4-6-15(13)16)19(23)22-17-11-14(20)8-10-18(17)24-2/h3-6,8,10-12,16,21H,7,9H2,1-2H3,(H,22,23).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide has a molecular weight of 344.84 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 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-dihydro-1H-inden-1-ylamino)propanamide is sourced from PubChem (CID 42887654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).