5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide

C20H25NO5 — CID 67845348

IUPAC5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide
SMILESCOc1ccc(C(CCCc2cc(O)c(OC)c(OC)c2)C(N)=O)cc1
InChIInChI=1S/C20H25NO5/c1-24-15-9-7-14(8-10-15)16(20(21)23)6-4-5-13-11-17(22)19(26-3)18(12-13)25-2/h7-12,16,22H,4-6H2,1-3H3,(H2,21,23)
InChIKeyFQJKKWFORQZKFY-UHFFFAOYSA-N
MW359.42 g/mol
LogP3.01
Rot. Bonds9

About 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide

5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide (PubChem CID 67845348) has the molecular formula C20H25NO5 and a molecular weight of 359.42 g/mol. Its IUPAC name is 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide.

Molecular Properties

Compound Name5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide
PubChem CID67845348
Molecular FormulaC20H25NO5
Molecular Weight359.42 g/mol
Exact Mass359.17
IUPAC Name5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide
SMILESCOc1ccc(C(CCCc2cc(O)c(OC)c(OC)c2)C(N)=O)cc1
InChIInChI=1S/C20H25NO5/c1-24-15-9-7-14(8-10-15)16(20(21)23)6-4-5-13-11-17(22)19(26-3)18(12-13)25-2/h7-12,16,22H,4-6H2,1-3H3,(H2,21,23)
InChIKeyFQJKKWFORQZKFY-UHFFFAOYSA-N
XLogP3.01
TPSA91.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.42
LogP ≤ 53.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenyl-4-(3,4,5-trimethoxyphenyl)butanamide
CID 175712395
N-[2-(3-hydroxy-4,5-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)propanamide
CID 15341356
2-(4-methoxyphenyl)octanediamide
CID 170724360
5-[2-(3,5-dimethoxyphenyl)ethyl]-2,3-dimethoxyphenol
CID 171933718
5-[2-(3-hydroxy-4,5-dimethoxyphenyl)ethyl]benzene-1,2,3-triol
CID 172870539
1-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)propan-1-amine;hydrochloride
CID 54605246
5-hydroxy-2-[2-(3-hydroxy-4,5-dimethoxyphenyl)ethyl]-4-oxopentanoic acid
CID 175274460
4-(3-hydroxy-4,5-dimethoxyphenyl)butan-2-one
CID 86067899
5-heptadecyl-2,3-dimethoxyphenol
CID 11794867
3-(4-methoxyphenyl)propyl 3-(3,4,5-trimethoxyphenyl)propanoate
CID 11292180
5-(4-methoxyphenyl)-2-phenylpentanoic acid
CID 81008725
2-(3-hydroxy-4,5-dimethoxyphenyl)ethylazanium
CID 86311037

Frequently Asked Questions

What is the IUPAC name of 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide?
The IUPAC name of 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide (CID 67845348) is 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide.
What is the SMILES notation for 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide?
The canonical SMILES for 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide is COc1ccc(C(CCCc2cc(O)c(OC)c(OC)c2)C(N)=O)cc1.
What is the InChIKey of 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide?
The InChIKey is FQJKKWFORQZKFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO5/c1-24-15-9-7-14(8-10-15)16(20(21)23)6-4-5-13-11-17(22)19(26-3)18(12-13)25-2/h7-12,16,22H,4-6H2,1-3H3,(H2,21,23).
What are the key properties of 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide?
5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide has a molecular weight of 359.42 g/mol, XLogP of 3.01, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxy-4,5-dimethoxyphenyl)-2-(4-methoxyphenyl)pentanamide is sourced from PubChem (CID 67845348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).