2-(4-tert-butylphenyl)pentanamide

C15H23NO — CID 10728355

IUPAC2-(4-tert-butylphenyl)pentanamide
SMILESCCCC(C(N)=O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H23NO/c1-5-6-13(14(16)17)11-7-9-12(10-8-11)15(2,3)4/h7-10,13H,5-6H2,1-4H3,(H2,16,17)
InChIKeyYLSGLKSMHDHZJQ-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.35
Rot. Bonds4

About 2-(4-tert-butylphenyl)pentanamide

2-(4-tert-butylphenyl)pentanamide (PubChem CID 10728355) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is 2-(4-tert-butylphenyl)pentanamide.

Molecular Properties

Compound Name2-(4-tert-butylphenyl)pentanamide
PubChem CID10728355
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC Name2-(4-tert-butylphenyl)pentanamide
SMILESCCCC(C(N)=O)c1ccc(C(C)(C)C)cc1
InChIInChI=1S/C15H23NO/c1-5-6-13(14(16)17)11-7-9-12(10-8-11)15(2,3)4/h7-10,13H,5-6H2,1-4H3,(H2,16,17)
InChIKeyYLSGLKSMHDHZJQ-UHFFFAOYSA-N
XLogP3.35
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

methyl (2S)-2-(4-tert-butylphenyl)pentanoate
CID 93492943
2-(4-methylphenyl)pentanamide
CID 91135302
(2R)-2-(4-tert-butylphenyl)-4-phenylbutanamide
CID 129383585
(2S)-2-(3,4-dihydroxyphenyl)pentanamide
CID 5324670
2-[4-(1-amino-1-oxooctadecan-2-yl)phenyl]octadecanamide
CID 18459559
3-(4-tert-butylphenyl)-2-(4-fluorophenyl)propanamide
CID 68577173
2-(3,5-dihydroxyphenyl)pentanamide
CID 139605066
2-[4-(trifluoromethyl)phenyl]pentanoic acid
CID 68887185
(1S)-1-(4-tert-butylphenyl)butan-1-amine;hydrochloride
CID 50999225
2-(4-tert-butylphenyl)-2-chloroacetamide
CID 62226048
ethyl (2S)-2-(4-tert-butylphenyl)-2-hydroxyacetate
CID 94376486
2-[4-(2-oxopiperidin-1-yl)phenyl]pentanamide
CID 141059160

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenyl)pentanamide?
The IUPAC name of 2-(4-tert-butylphenyl)pentanamide (CID 10728355) is 2-(4-tert-butylphenyl)pentanamide.
What is the SMILES notation for 2-(4-tert-butylphenyl)pentanamide?
The canonical SMILES for 2-(4-tert-butylphenyl)pentanamide is CCCC(C(N)=O)c1ccc(C(C)(C)C)cc1.
What is the InChIKey of 2-(4-tert-butylphenyl)pentanamide?
The InChIKey is YLSGLKSMHDHZJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-5-6-13(14(16)17)11-7-9-12(10-8-11)15(2,3)4/h7-10,13H,5-6H2,1-4H3,(H2,16,17).
What are the key properties of 2-(4-tert-butylphenyl)pentanamide?
2-(4-tert-butylphenyl)pentanamide has a molecular weight of 233.35 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenyl)pentanamide is sourced from PubChem (CID 10728355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).