N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide

C27H36N2O3 — CID 132611360

IUPACN-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide
SMILESCC(C)c1ccccc1OCC(=O)N(CCc1ccccc1)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C27H36N2O3/c1-20(2)24-15-9-10-16-25(24)32-19-26(30)29(18-17-22-11-5-4-6-12-22)21(3)27(31)28-23-13-7-8-14-23/h4-6,9-12,15-16,20-21,23H,7-8,13-14,17-19H2,1-3H3,(H,28,31)
InChIKeySYBJJVAQKYMELJ-UHFFFAOYSA-N
MW436.60 g/mol
LogP4.71
Rot. Bonds10

About N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide

N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide (PubChem CID 132611360) has the molecular formula C27H36N2O3 and a molecular weight of 436.60 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide
PubChem CID132611360
Molecular FormulaC27H36N2O3
Molecular Weight436.60 g/mol
Exact Mass436.27
IUPAC NameN-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide
SMILESCC(C)c1ccccc1OCC(=O)N(CCc1ccccc1)C(C)C(=O)NC1CCCC1
InChIInChI=1S/C27H36N2O3/c1-20(2)24-15-9-10-16-25(24)32-19-26(30)29(18-17-22-11-5-4-6-12-22)21(3)27(31)28-23-13-7-8-14-23/h4-6,9-12,15-16,20-21,23H,7-8,13-14,17-19H2,1-3H3,(H,28,31)
InChIKeySYBJJVAQKYMELJ-UHFFFAOYSA-N
XLogP4.71
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.60
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[benzyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]-N-cyclopentylpropanamide
CID 132947940
N-cyclopentyl-2-[[2-(2-methylphenoxy)acetyl]-(2-phenylethyl)amino]propanamide
CID 132985880
(2R)-N-cyclohexyl-2-[[2-(2-fluorophenoxy)acetyl]-(2-phenylethyl)amino]propanamide
CID 100521715
(2S)-N-cyclohexyl-2-[2-phenylethyl-[2-(4-propan-2-ylphenoxy)acetyl]amino]propanamide
CID 100520603
2-[benzyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]-N-cyclohexyl-3-phenylpropanamide
CID 133175887
(2R)-N-cyclohexyl-2-[2-phenylethyl-[2-(2,3,5-trimethylphenoxy)acetyl]amino]propanamide
CID 100520633
2-[[2-(4-bromo-2-chlorophenoxy)acetyl]-(2-phenylethyl)amino]-N-cyclopentylpropanamide
CID 132620435
(2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide
CID 100517141
(2R)-N-cyclohexyl-2-[2-phenylethyl(propanoyl)amino]propanamide
CID 100521838
(2S)-2-[[2-(2-bromo-4-ethylphenoxy)acetyl]-(2-phenylethyl)amino]-N-cyclohexylpropanamide
CID 100520359
(2R)-2-[[2-(2-bromo-4-ethylphenoxy)acetyl]-(2-phenylethyl)amino]-N-cyclohexylpropanamide
CID 100520367
N-[1-(cyclopentylamino)-1-oxopropan-2-yl]-3,3-diphenyl-N-(2-phenylethyl)propanamide
CID 132615250

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide?
The IUPAC name of N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide (CID 132611360) is N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide.
What is the SMILES notation for N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide?
The canonical SMILES for N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide is CC(C)c1ccccc1OCC(=O)N(CCc1ccccc1)C(C)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide?
The InChIKey is SYBJJVAQKYMELJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H36N2O3/c1-20(2)24-15-9-10-16-25(24)32-19-26(30)29(18-17-22-11-5-4-6-12-22)21(3)27(31)28-23-13-7-8-14-23/h4-6,9-12,15-16,20-21,23H,7-8,13-14,17-19H2,1-3H3,(H,28,31).
What are the key properties of N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide?
N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide has a molecular weight of 436.60 g/mol, XLogP of 4.71, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-phenylethyl-[2-(2-propan-2-ylphenoxy)acetyl]amino]propanamide is sourced from PubChem (CID 132611360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).