3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide

C24H23NO4 — CID 91476700

IUPAC3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide
SMILESCOc1ccc(C=C(C)C(=O)Nc2cccc(OCc3ccccc3)c2)cc1O
InChIInChI=1S/C24H23NO4/c1-17(13-19-11-12-23(28-2)22(26)14-19)24(27)25-20-9-6-10-21(15-20)29-16-18-7-4-3-5-8-18/h3-15,26H,16H2,1-2H3,(H,25,27)
InChIKeyJJIMSEXRSAYSRO-UHFFFAOYSA-N
MW389.45 g/mol
LogP5.02
Rot. Bonds7

About 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide

3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide (PubChem CID 91476700) has the molecular formula C24H23NO4 and a molecular weight of 389.45 g/mol. Its IUPAC name is 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide.

Molecular Properties

Compound Name3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide
PubChem CID91476700
Molecular FormulaC24H23NO4
Molecular Weight389.45 g/mol
Exact Mass389.16
IUPAC Name3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide
SMILESCOc1ccc(C=C(C)C(=O)Nc2cccc(OCc3ccccc3)c2)cc1O
InChIInChI=1S/C24H23NO4/c1-17(13-19-11-12-23(28-2)22(26)14-19)24(27)25-20-9-6-10-21(15-20)29-16-18-7-4-3-5-8-18/h3-15,26H,16H2,1-2H3,(H,25,27)
InChIKeyJJIMSEXRSAYSRO-UHFFFAOYSA-N
XLogP5.02
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.45
LogP ≤ 55.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-3-(3-hydroxy-4-methoxyphenyl)-N-(3-phenylmethoxyphenyl)prop-2-enamide
CID 45376472
(E)-3-(3,4-dimethoxyphenyl)-N-(3-methoxyphenyl)-2-methylprop-2-enamide
CID 84575847
(E)-2-benzoyl-3-(3-hydroxy-4-methoxyphenyl)-N-(3-methoxyphenyl)prop-2-enamide
CID 9448911
2-[[(E)-3-(3-methoxy-4-phenylmethoxyphenyl)-2-methylprop-2-enoyl]amino]benzoic acid
CID 71299863
(E)-4-(3-hydroxy-4-methoxyphenyl)-1-[3-(pyridin-4-ylmethoxy)phenyl]but-3-en-2-one
CID 58387279
(E)-4-(4-methoxy-3-phenylmethoxyphenyl)-3-methylbut-3-en-2-one
CID 22246671
2,4-dimethoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 54790493
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
N-(3-methylphenyl)-N'-[(E)-(3-phenylmethoxyphenyl)methylideneamino]oxamide
CID 45055326
4-chloro-N-(3-phenylmethoxyphenyl)butanamide
CID 17161005
(E)-N-(3-ethoxyphenyl)-2-methylbut-2-enamide
CID 134119682
N-methoxy-3-(4-methoxy-3-phenylmethoxyphenyl)-N,2-dimethylprop-2-enamide
CID 73443908

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide?
The IUPAC name of 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide (CID 91476700) is 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide.
What is the SMILES notation for 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide?
The canonical SMILES for 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide is COc1ccc(C=C(C)C(=O)Nc2cccc(OCc3ccccc3)c2)cc1O.
What is the InChIKey of 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide?
The InChIKey is JJIMSEXRSAYSRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO4/c1-17(13-19-11-12-23(28-2)22(26)14-19)24(27)25-20-9-6-10-21(15-20)29-16-18-7-4-3-5-8-18/h3-15,26H,16H2,1-2H3,(H,25,27).
What are the key properties of 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide?
3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide has a molecular weight of 389.45 g/mol, XLogP of 5.02, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxy-4-methoxyphenyl)-2-methyl-N-(3-phenylmethoxyphenyl)prop-2-enamide is sourced from PubChem (CID 91476700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).