N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide

C20H23ClN2O2 — CID 42926295

IUPACN-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)C(C)NC1CCc2ccccc21
InChIInChI=1S/C20H23ClN2O2/c1-12-10-18(19(25-3)11-16(12)21)23-20(24)13(2)22-17-9-8-14-6-4-5-7-15(14)17/h4-7,10-11,13,17,22H,8-9H2,1-3H3,(H,23,24)
InChIKeyJZTHDLIFBQZNPF-UHFFFAOYSA-N
MW358.87 g/mol
LogP4.26
Rot. Bonds5

About N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide

N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide (PubChem CID 42926295) has the molecular formula C20H23ClN2O2 and a molecular weight of 358.87 g/mol. Its IUPAC name is N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide.

Molecular Properties

Compound NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
PubChem CID42926295
Molecular FormulaC20H23ClN2O2
Molecular Weight358.87 g/mol
Exact Mass358.14
IUPAC NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)C(C)NC1CCc2ccccc21
InChIInChI=1S/C20H23ClN2O2/c1-12-10-18(19(25-3)11-16(12)21)23-20(24)13(2)22-17-9-8-14-6-4-5-7-15(14)17/h4-7,10-11,13,17,22H,8-9H2,1-3H3,(H,23,24)
InChIKeyJZTHDLIFBQZNPF-UHFFFAOYSA-N
XLogP4.26
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.87
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chloro-2-methoxyphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide
CID 42887654
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(2-methoxyphenyl)propanamide
CID 42926288
N-(4-chloro-2-methoxy-5-methylphenyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43102702
methyl 2-(2,3-dihydro-1H-inden-1-ylamino)propanoate
CID 60780698
N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopropylpropanamide
CID 110428070
2-bromo-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide
CID 107902832
(2R)-2-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide
CID 41192472
2-(2,3-dihydro-1H-inden-1-ylamino)-N-(3-fluorophenyl)propanamide
CID 42883500
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoacetamide
CID 108525666
1-(4-chloro-2-methoxy-5-methylphenyl)-3-(1-phenylethyl)urea
CID 108988820
(2S)-N-(4-chloro-2-methoxy-5-methylphenyl)-2-(1,3-dioxoisoindol-2-yl)propanamide
CID 7788336
(2R)-2-(4-chloro-2-methoxy-5-methylanilino)-N-(2,3,4-trifluorophenyl)propanamide
CID 2471713

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
The IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide (CID 42926295) is N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide.
What is the SMILES notation for N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
The canonical SMILES for N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide is COc1cc(Cl)c(C)cc1NC(=O)C(C)NC1CCc2ccccc21.
What is the InChIKey of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
The InChIKey is JZTHDLIFBQZNPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23ClN2O2/c1-12-10-18(19(25-3)11-16(12)21)23-20(24)13(2)22-17-9-8-14-6-4-5-7-15(14)17/h4-7,10-11,13,17,22H,8-9H2,1-3H3,(H,23,24).
What are the key properties of N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide?
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide has a molecular weight of 358.87 g/mol, XLogP of 4.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methoxy-5-methylphenyl)-2-(2,3-dihydro-1H-inden-1-ylamino)propanamide is sourced from PubChem (CID 42926295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).