N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide

C20H24N2O5 — CID 39991372

IUPACN-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)Cc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C20H24N2O5/c1-5-18(23)21-14-7-6-8-15(12-14)22-19(24)11-13-9-16(25-2)20(27-4)17(10-13)26-3/h6-10,12H,5,11H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyQVDXPEWTVHKTGY-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.24
Rot. Bonds8

About N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide

N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide (PubChem CID 39991372) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide.

Molecular Properties

Compound NameN-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide
PubChem CID39991372
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC NameN-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide
SMILESCCC(=O)Nc1cccc(NC(=O)Cc2cc(OC)c(OC)c(OC)c2)c1
InChIInChI=1S/C20H24N2O5/c1-5-18(23)21-14-7-6-8-15(12-14)22-19(24)11-13-9-16(25-2)20(27-4)17(10-13)26-3/h6-10,12H,5,11H2,1-4H3,(H,21,23)(H,22,24)
InChIKeyQVDXPEWTVHKTGY-UHFFFAOYSA-N
XLogP3.24
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,2-dimethyl-N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide
CID 30671146
N-(3-iodophenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 26517733
N-(3-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2406485
2-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]acetic acid
CID 119351773
N-[3-(difluoromethoxy)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 55742320
N-pyridin-4-yl-2-(3,4,5-trimethoxyphenyl)acetamide
CID 27700068
N-(4-acetamidophenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 4884121
3,4,5-trimethoxy-N-[3-[(2-phenylacetyl)amino]phenyl]benzamide
CID 17235540
N-(4-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2665020
N-[3-(1,3-dioxoisoindol-2-yl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 56507447
N-(2-anilino-2-oxoethyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 55836388
N-(4-acetylphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2597337

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide?
The IUPAC name of N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide (CID 39991372) is N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide.
What is the SMILES notation for N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide?
The canonical SMILES for N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide is CCC(=O)Nc1cccc(NC(=O)Cc2cc(OC)c(OC)c(OC)c2)c1.
What is the InChIKey of N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide?
The InChIKey is QVDXPEWTVHKTGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-5-18(23)21-14-7-6-8-15(12-14)22-19(24)11-13-9-16(25-2)20(27-4)17(10-13)26-3/h6-10,12H,5,11H2,1-4H3,(H,21,23)(H,22,24).
What are the key properties of N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide?
N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide has a molecular weight of 372.42 g/mol, XLogP of 3.24, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(3,4,5-trimethoxyphenyl)acetyl]amino]phenyl]propanamide is sourced from PubChem (CID 39991372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).