(2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide

C20H25NO — CID 129383585

IUPAC(2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide
SMILESCC(C)(C)c1ccc([C@@H](CCc2ccccc2)C(N)=O)cc1
InChIInChI=1S/C20H25NO/c1-20(2,3)17-12-10-16(11-13-17)18(19(21)22)14-9-15-7-5-4-6-8-15/h4-8,10-13,18H,9,14H2,1-3H3,(H2,21,22)/t18-/m1/s1
InChIKeyZDPSCXIXWCHVLY-GOSISDBHSA-N
MW295.43 g/mol
LogP4.19
Rot. Bonds5

About (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide

(2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide (PubChem CID 129383585) has the molecular formula C20H25NO and a molecular weight of 295.43 g/mol. Its IUPAC name is (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide.

Molecular Properties

Compound Name(2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide
PubChem CID129383585
Molecular FormulaC20H25NO
Molecular Weight295.43 g/mol
Exact Mass295.19
IUPAC Name(2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide
SMILESCC(C)(C)c1ccc([C@@H](CCc2ccccc2)C(N)=O)cc1
InChIInChI=1S/C20H25NO/c1-20(2,3)17-12-10-16(11-13-17)18(19(21)22)14-9-15-7-5-4-6-8-15/h4-8,10-13,18H,9,14H2,1-3H3,(H2,21,22)/t18-/m1/s1
InChIKeyZDPSCXIXWCHVLY-GOSISDBHSA-N
XLogP4.19
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-tert-butylphenyl)pentanamide
CID 10728355
4-(4-bromophenyl)-2,2-dimethyl-6-phenylhexan-3-one
CID 13458706
4-(3-hydroxyphenyl)-2-(4-phenylphenyl)butanamide
CID 174603850
(2R)-2-(4-methylphenyl)-4-phenylbutanoic acid
CID 94724465
3-(4-tert-butylphenyl)-2-(4-fluorophenyl)propanamide
CID 68577173
2-(2-phenylethyl)propanediamide
CID 66660020
2-phenyl-4-(3,4,5-trimethoxyphenyl)butanamide
CID 175712395
1-(4-tert-butylphenyl)-5-phenylpentan-3-one
CID 71658450
1-(4-tert-butylphenyl)-4-phenylbutan-2-amine
CID 63417179
1-(4-tert-butylphenyl)-2,3-diphenylpropan-1-one
CID 135032816
1-tert-butyl-4-[1-(4-methoxyphenyl)-3-phenylpropyl]benzene
CID 168720165
(2S)-2-methyl-4-phenylbutanamide;molecular hydrogen
CID 143947472

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide?
The IUPAC name of (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide (CID 129383585) is (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide.
What is the SMILES notation for (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide?
The canonical SMILES for (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide is CC(C)(C)c1ccc([C@@H](CCc2ccccc2)C(N)=O)cc1.
What is the InChIKey of (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide?
The InChIKey is ZDPSCXIXWCHVLY-GOSISDBHSA-N. The full InChI is InChI=1S/C20H25NO/c1-20(2,3)17-12-10-16(11-13-17)18(19(21)22)14-9-15-7-5-4-6-8-15/h4-8,10-13,18H,9,14H2,1-3H3,(H2,21,22)/t18-/m1/s1.
What are the key properties of (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide?
(2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide has a molecular weight of 295.43 g/mol, XLogP of 4.19, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide is sourced from PubChem (CID 129383585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).