3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide

C24H27NO4 — CID 57235125

IUPAC3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide
SMILESCOc1ccc(C(C#Cc2ccccc2)(CC(N)=O)OC)cc1OC1CCCC1
InChIInChI=1S/C24H27NO4/c1-27-21-13-12-19(16-22(21)29-20-10-6-7-11-20)24(28-2,17-23(25)26)15-14-18-8-4-3-5-9-18/h3-5,8-9,12-13,16,20H,6-7,10-11,17H2,1-2H3,(H2,25,26)
InChIKeyFIRCODKWLABWJB-UHFFFAOYSA-N
MW393.48 g/mol
LogP3.79
Rot. Bonds7

About 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide

3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide (PubChem CID 57235125) has the molecular formula C24H27NO4 and a molecular weight of 393.48 g/mol. Its IUPAC name is 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide.

Molecular Properties

Compound Name3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide
PubChem CID57235125
Molecular FormulaC24H27NO4
Molecular Weight393.48 g/mol
Exact Mass393.19
IUPAC Name3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide
SMILESCOc1ccc(C(C#Cc2ccccc2)(CC(N)=O)OC)cc1OC1CCCC1
InChIInChI=1S/C24H27NO4/c1-27-21-13-12-19(16-22(21)29-20-10-6-7-11-20)24(28-2,17-23(25)26)15-14-18-8-4-3-5-9-18/h3-5,8-9,12-13,16,20H,6-7,10-11,17H2,1-2H3,(H2,25,26)
InChIKeyFIRCODKWLABWJB-UHFFFAOYSA-N
XLogP3.79
TPSA70.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.48
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide 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

3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methyl-5-phenylpent-4-ynamide
CID 56987832
(3S)-3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methyl-5-phenylpent-4-ynoic acid
CID 70066184
2-cyclopentyloxy-4-(3-ethyl-1-phenylhex-1-yn-3-yl)-1-methoxybenzene
CID 57298170
3-(3-cyclobutyloxy-4-methoxyphenyl)-3-methylbutanoic acid
CID 117446285
3-(4-cyclopentyloxy-3-methoxyphenyl)-3-methylbutanoic acid
CID 117472193
benzamide;3-cyclopentyloxy-4-methoxybenzamide
CID 18691056
3-(3-cyclopentyloxy-4-methoxyphenyl)-N,N-dimethyl-5-phenylpent-4-ynamide
CID 54555142
N-[2-(3-cyclopentyloxy-4-methoxyphenyl)-4-phenylbut-3-ynyl]-3-oxobutanamide
CID 54216808
5-[2-(3-cyclopentyloxy-4-methoxyphenyl)-4-phenylbut-3-ynyl]-2H-tetrazole
CID 19349937
2-amino-1-(3-cyclopentyloxy-4-methoxyphenyl)ethanone
CID 117376031
tert-butyl N-[3-(3-cyclopentyloxy-4-methoxyphenyl)-3-(2-phenylethynyl)cyclobutyl]carbamate
CID 20638963
3-(3-cyclopentyloxy-4-methoxyphenyl)-3-(2-phenylethynyl)cyclohexan-1-one
CID 15392008

Frequently Asked Questions

What is the IUPAC name of 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide?
The IUPAC name of 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide (CID 57235125) is 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide.
What is the SMILES notation for 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide?
The canonical SMILES for 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide is COc1ccc(C(C#Cc2ccccc2)(CC(N)=O)OC)cc1OC1CCCC1.
What is the InChIKey of 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide?
The InChIKey is FIRCODKWLABWJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27NO4/c1-27-21-13-12-19(16-22(21)29-20-10-6-7-11-20)24(28-2,17-23(25)26)15-14-18-8-4-3-5-9-18/h3-5,8-9,12-13,16,20H,6-7,10-11,17H2,1-2H3,(H2,25,26).
What are the key properties of 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide?
3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide has a molecular weight of 393.48 g/mol, XLogP of 3.79, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclopentyloxy-4-methoxyphenyl)-3-methoxy-5-phenylpent-4-ynamide is sourced from PubChem (CID 57235125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).