N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide

C20H25NO — CID 2268559

IUPACN-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide
SMILESCCC[C@H](C)NC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO/c1-3-10-16(2)21-20(22)15-19(17-11-6-4-7-12-17)18-13-8-5-9-14-18/h4-9,11-14,16,19H,3,10,15H2,1-2H3,(H,21,22)/t16-/m0/s1
InChIKeyNCRMWFRLPUVMHR-INIZCTEOSA-N
MW295.43 g/mol
LogP4.51
Rot. Bonds7

About N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide

N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide (PubChem CID 2268559) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide.

Molecular Properties

Compound NameN-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide
PubChem CID2268559
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC NameN-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide
SMILESCCC[C@H](C)NC(=O)CC(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H25NO/c1-3-10-16(2)21-20(22)15-19(17-11-6-4-7-12-17)18-13-8-5-9-14-18/h4-9,11-14,16,19H,3,10,15H2,1-2H3,(H,21,22)/t16-/m0/s1
InChIKeyNCRMWFRLPUVMHR-INIZCTEOSA-N
XLogP4.51
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2R)-1-methoxypropan-2-yl]-3,3-diphenylpropanamide
CID 7299747
N-pentan-2-yl-2-(1-phenylethylamino)acetamide
CID 60684136
N-[4-oxo-4-(pentan-2-ylamino)butan-2-yl]benzamide
CID 24639425
3,3-diphenyl-N-propylpropanamide
CID 4638647
(2S)-2-amino-N-pentan-2-yl-2-phenylacetamide
CID 104897097
N-[(1S)-3-methyl-1-phenylbutyl]-3,3-diphenylpropanamide
CID 38003610
N-[1-(4-ethylphenyl)ethyl]-3,3-diphenylpropanamide
CID 17326867
(3R)-3-(hydroxymethyl)-N-[(1S)-1-phenylethyl]hexanamide
CID 154648376
N-methyl-3,3-diphenylpropanamide
CID 3373592
(2S)-2-(pentan-2-ylcarbamoylamino)-2-phenylacetic acid
CID 113363099
(3S)-3-phenyl-N-[(2R)-4-phenylbutan-2-yl]butanamide
CID 40591277
N-pentan-2-yl-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 78948251

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide?
The IUPAC name of N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide (CID 2268559) is N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide.
What is the SMILES notation for N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide?
The canonical SMILES for N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide is CCC[C@H](C)NC(=O)CC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide?
The InChIKey is NCRMWFRLPUVMHR-INIZCTEOSA-N. The full InChI is InChI=1S/C20H25NO/c1-3-10-16(2)21-20(22)15-19(17-11-6-4-7-12-17)18-13-8-5-9-14-18/h4-9,11-14,16,19H,3,10,15H2,1-2H3,(H,21,22)/t16-/m0/s1.
What are the key properties of N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide?
N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide has a molecular weight of 295.43 g/mol, XLogP of 4.51, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-pentan-2-yl]-3,3-diphenylpropanamide is sourced from PubChem (CID 2268559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).