N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide

C21H27NO3 — CID 133166359

IUPACN-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide
SMILESCCC(NC(=O)C(C)Oc1ccccc1C)c1ccc(OC)c(C)c1
InChIInChI=1S/C21H27NO3/c1-6-18(17-11-12-19(24-5)15(3)13-17)22-21(23)16(4)25-20-10-8-7-9-14(20)2/h7-13,16,18H,6H2,1-5H3,(H,22,23)
InChIKeyLIQLMJSQNNSPRR-UHFFFAOYSA-N
MW341.45 g/mol
LogP4.35
Rot. Bonds7

About N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide

N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide (PubChem CID 133166359) has the molecular formula C21H27NO3 and a molecular weight of 341.45 g/mol. Its IUPAC name is N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide
PubChem CID133166359
Molecular FormulaC21H27NO3
Molecular Weight341.45 g/mol
Exact Mass341.20
IUPAC NameN-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide
SMILESCCC(NC(=O)C(C)Oc1ccccc1C)c1ccc(OC)c(C)c1
InChIInChI=1S/C21H27NO3/c1-6-18(17-11-12-19(24-5)15(3)13-17)22-21(23)16(4)25-20-10-8-7-9-14(20)2/h7-13,16,18H,6H2,1-5H3,(H,22,23)
InChIKeyLIQLMJSQNNSPRR-UHFFFAOYSA-N
XLogP4.35
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methoxyphenoxy)propanamide
CID 133160157
2-(2,4-dimethylphenoxy)-N-[1-(4-methoxy-3-methylphenyl)propyl]propanamide
CID 133178453
N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(3-methoxyphenoxy)propanamide
CID 133186771
N-[1-(3,4-dimethylphenyl)propyl]-2-(2-methoxyphenoxy)propanamide
CID 132652272
2-(2,5-dimethylphenoxy)-N-[1-(4-methoxy-3-methylphenyl)propyl]propanamide
CID 133201746
(2S)-2-(2-methylphenoxy)-N-[(1R)-1-phenylpropyl]propanamide
CID 93234565
(2S)-2-(4-chloro-3-methylphenoxy)-N-[(1R)-1-(4-methoxy-3-methylphenyl)propyl]propanamide
CID 100772095
(2R)-2-(4-chloro-3-methylphenoxy)-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]propanamide
CID 100772091
(2S)-2-(2,4-dimethylphenoxy)-N-[(1S)-1-(4-methoxyphenyl)propyl]propanamide
CID 99132320
2-benzylsulfanyl-N-[1-(4-methoxy-3-methylphenyl)propyl]propanamide
CID 133200276
(2S)-N-[(1S)-1-(3,4-dimethylphenyl)ethyl]-2-(2-methylphenoxy)propanamide
CID 94843420
N-[1-(3,4-dimethylphenyl)ethyl]-2-(2-methylphenoxy)propanamide
CID 17326587

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide?
The IUPAC name of N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide (CID 133166359) is N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide.
What is the SMILES notation for N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide?
The canonical SMILES for N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide is CCC(NC(=O)C(C)Oc1ccccc1C)c1ccc(OC)c(C)c1.
What is the InChIKey of N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide?
The InChIKey is LIQLMJSQNNSPRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27NO3/c1-6-18(17-11-12-19(24-5)15(3)13-17)22-21(23)16(4)25-20-10-8-7-9-14(20)2/h7-13,16,18H,6H2,1-5H3,(H,22,23).
What are the key properties of N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide?
N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide has a molecular weight of 341.45 g/mol, XLogP of 4.35, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methoxy-3-methylphenyl)propyl]-2-(2-methylphenoxy)propanamide is sourced from PubChem (CID 133166359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).