(2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide

C26H34N2O2 — CID 100517141

IUPAC(2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide
SMILESC[C@H](C(=O)NC1CCCCC1)N(CCc1ccccc1)C(=O)CCc1ccccc1
InChIInChI=1S/C26H34N2O2/c1-21(26(30)27-24-15-9-4-10-16-24)28(20-19-23-13-7-3-8-14-23)25(29)18-17-22-11-5-2-6-12-22/h2-3,5-8,11-14,21,24H,4,9-10,15-20H2,1H3,(H,27,30)/t21-/m1/s1
InChIKeyFGLSAPJNDIAOLZ-OAQYLSRUSA-N
MW406.57 g/mol
LogP4.53
Rot. Bonds9

About (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide

(2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide (PubChem CID 100517141) has the molecular formula C26H34N2O2 and a molecular weight of 406.57 g/mol. Its IUPAC name is (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide.

Molecular Properties

Compound Name(2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide
PubChem CID100517141
Molecular FormulaC26H34N2O2
Molecular Weight406.57 g/mol
Exact Mass406.26
IUPAC Name(2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide
SMILESC[C@H](C(=O)NC1CCCCC1)N(CCc1ccccc1)C(=O)CCc1ccccc1
InChIInChI=1S/C26H34N2O2/c1-21(26(30)27-24-15-9-4-10-16-24)28(20-19-23-13-7-3-8-14-23)25(29)18-17-22-11-5-2-6-12-22/h2-3,5-8,11-14,21,24H,4,9-10,15-20H2,1H3,(H,27,30)/t21-/m1/s1
InChIKeyFGLSAPJNDIAOLZ-OAQYLSRUSA-N
XLogP4.53
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.57
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-[3-(4-tert-butylphenyl)propanoyl-(2-phenylethyl)amino]-N-cyclohexylpropanamide
CID 100519886
(2R)-N-cyclohexyl-2-[2-phenylethyl(propanoyl)amino]propanamide
CID 100521838
N-[1-(cyclopentylamino)-1-oxopropan-2-yl]-3,3-diphenyl-N-(2-phenylethyl)propanamide
CID 132615250
N-cyclopentyl-2-[3-(3,4-dimethoxyphenyl)propanoyl-(2-phenylethyl)amino]propanamide
CID 132613155
N-[(2S)-1-(cyclohexylamino)-1-oxopropan-2-yl]-4-(4-methylphenoxy)-N-(2-phenylethyl)butanamide
CID 100520067
(2R)-N-cyclohexyl-2-[2-phenylethyl-[3-(4-propan-2-ylphenyl)propanoyl]amino]butanamide
CID 100607646
(2S)-N-cyclohexyl-2-[[2-(N-methylsulfonylanilino)acetyl]-(2-phenylethyl)amino]propanamide
CID 100518262
2-[[2-(2-chlorophenyl)acetyl]-(2-phenylethyl)amino]-N-cyclopentylpropanamide
CID 132984685
N-[1-(cyclohexylamino)-1-oxopropan-2-yl]-4-(4-methyl-N-methylsulfonylanilino)-N-(2-phenylethyl)butanamide
CID 132623161
N-cyclohexyl-2-[[2-(2,6-dichlorophenyl)acetyl]-(2-phenylethyl)amino]propanamide
CID 132614260
N-cyclopentyl-2-[[2-(N-methylsulfonylanilino)acetyl]-(2-phenylethyl)amino]propanamide
CID 132615646
N-cyclohexyl-2-[[2-(3,4-dimethylphenyl)acetyl]-(2-phenylethyl)amino]propanamide
CID 132947782

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide?
The IUPAC name of (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide (CID 100517141) is (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide.
What is the SMILES notation for (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide?
The canonical SMILES for (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide is C[C@H](C(=O)NC1CCCCC1)N(CCc1ccccc1)C(=O)CCc1ccccc1.
What is the InChIKey of (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide?
The InChIKey is FGLSAPJNDIAOLZ-OAQYLSRUSA-N. The full InChI is InChI=1S/C26H34N2O2/c1-21(26(30)27-24-15-9-4-10-16-24)28(20-19-23-13-7-3-8-14-23)25(29)18-17-22-11-5-2-6-12-22/h2-3,5-8,11-14,21,24H,4,9-10,15-20H2,1H3,(H,27,30)/t21-/m1/s1.
What are the key properties of (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide?
(2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide has a molecular weight of 406.57 g/mol, XLogP of 4.53, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclohexyl-2-[2-phenylethyl(3-phenylpropanoyl)amino]propanamide is sourced from PubChem (CID 100517141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).