N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide

C17H18ClNO3 — CID 868614

IUPACN-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2cc(Cl)ccc2OC)cc1
InChIInChI=1S/C17H18ClNO3/c1-21-14-7-3-12(4-8-14)5-10-17(20)19-15-11-13(18)6-9-16(15)22-2/h3-4,6-9,11H,5,10H2,1-2H3,(H,19,20)
InChIKeyFKZNRKCPMRUCGH-UHFFFAOYSA-N
MW319.79 g/mol
LogP3.93
Rot. Bonds6

About N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide

N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide (PubChem CID 868614) has the molecular formula C17H18ClNO3 and a molecular weight of 319.79 g/mol. Its IUPAC name is N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
PubChem CID868614
Molecular FormulaC17H18ClNO3
Molecular Weight319.79 g/mol
Exact Mass319.10
IUPAC NameN-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
SMILESCOc1ccc(CCC(=O)Nc2cc(Cl)ccc2OC)cc1
InChIInChI=1S/C17H18ClNO3/c1-21-14-7-3-12(4-8-14)5-10-17(20)19-15-11-13(18)6-9-16(15)22-2/h3-4,6-9,11H,5,10H2,1-2H3,(H,19,20)
InChIKeyFKZNRKCPMRUCGH-UHFFFAOYSA-N
XLogP3.93
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-Chloro-2-methoxyphenyl)-3-oxobutanamide
CID 98791
N-(2-methoxy-5-methylphenyl)-2-phenylcyclopropane-1-carboxamide
CID 2862625
2-Chlorodibenz(b,f)-1,4-oxazepin-11(10H)-one
CID 76619
N-(5-Chloro-2-methoxyphenyl)-2-methylbenzamide
CID 576984
N,N'-bis(5-chloro-2-methoxyphenyl)propanediamide
CID 2386166
2'-Methoxy-2-phenylacetanilide
CID 258229
3'-Chloro-4-methoxybenzanilide
CID 346039
N-(5-chloro-2-methoxyphenyl)-2-methoxy-2-phenylacetamide
CID 2897418
Benzamide, N-(4-amino-5-chloro-2-methoxyphenyl)-
CID 80727
N-(3-Chlorophenyl)-3-(4-methoxyphenyl)propanamide
CID 903519
3-[(3-chlorophenyl)amino]-4-(4-methoxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione
CID 6539464
1-(4-chlorophenyl)ethyl N-(2-methoxyphenyl)carbamate
CID 4885255

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The IUPAC name of N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide (CID 868614) is N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide.
What is the SMILES notation for N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The canonical SMILES for N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide is COc1ccc(CCC(=O)Nc2cc(Cl)ccc2OC)cc1.
What is the InChIKey of N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
The InChIKey is FKZNRKCPMRUCGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO3/c1-21-14-7-3-12(4-8-14)5-10-17(20)19-15-11-13(18)6-9-16(15)22-2/h3-4,6-9,11H,5,10H2,1-2H3,(H,19,20).
What are the key properties of N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide?
N-(5-chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide has a molecular weight of 319.79 g/mol, XLogP of 3.93, 6 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-(4-methoxyphenyl)propanamide is sourced from PubChem (CID 868614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).