2-propyl-N-(2,4,6-trimethylphenyl)pentanamide

C17H27NO — CID 11841490

IUPAC2-propyl-N-(2,4,6-trimethylphenyl)pentanamide
SMILESCCCC(CCC)C(=O)Nc1c(C)cc(C)cc1C
InChIInChI=1S/C17H27NO/c1-6-8-15(9-7-2)17(19)18-16-13(4)10-12(3)11-14(16)5/h10-11,15H,6-9H2,1-5H3,(H,18,19)
InChIKeyRRTNSIHTUBBZRE-UHFFFAOYSA-N
MW261.41 g/mol
LogP4.77
Rot. Bonds6

About 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide

2-propyl-N-(2,4,6-trimethylphenyl)pentanamide (PubChem CID 11841490) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide.

Molecular Properties

Compound Name2-propyl-N-(2,4,6-trimethylphenyl)pentanamide
PubChem CID11841490
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name2-propyl-N-(2,4,6-trimethylphenyl)pentanamide
SMILESCCCC(CCC)C(=O)Nc1c(C)cc(C)cc1C
InChIInChI=1S/C17H27NO/c1-6-8-15(9-7-2)17(19)18-16-13(4)10-12(3)11-14(16)5/h10-11,15H,6-9H2,1-5H3,(H,18,19)
InChIKeyRRTNSIHTUBBZRE-UHFFFAOYSA-N
XLogP4.77
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-N,2-N,3-N-tris(2,4,6-trimethylphenyl)propane-1,2,3-tricarboxamide
CID 67992232
(2S)-2-amino-N-(2,4,6-trimethylphenyl)hexanamide
CID 103830837
N-(4-bromo-3,5-dimethylphenyl)-2-propylpentanamide
CID 107575057
N,N'-bis(2,4,6-trimethylphenyl)propanediamide
CID 746178
2-ethyl-N-[4-(hydroxymethyl)-2,6-dimethylphenyl]heptanamide
CID 168944628
N,N'-bis(2,4,6-trimethylphenyl)oxamide
CID 13271247
(2R)-2-amino-3-methyl-N-(2,4,6-trimethylphenyl)butanamide
CID 79011703
2-cyano-N-(2,4,6-trimethylphenyl)propanamide
CID 55207019
2-amino-3,3-dimethyl-N-(2,4,6-trimethylphenyl)butanamide
CID 76892574
N-(2-bromo-5-chloro-4-methylphenyl)-2-propylpentanamide
CID 113445559
2-(aminomethyl)-N-(2,4-dimethyl-3-pyridinyl)pentanamide
CID 112741868
1-(2-chloro-4,6-dimethylphenyl)-3-[(2R)-pentan-2-yl]urea
CID 51928207

Frequently Asked Questions

What is the IUPAC name of 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide?
The IUPAC name of 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide (CID 11841490) is 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide.
What is the SMILES notation for 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide?
The canonical SMILES for 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide is CCCC(CCC)C(=O)Nc1c(C)cc(C)cc1C.
What is the InChIKey of 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide?
The InChIKey is RRTNSIHTUBBZRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-6-8-15(9-7-2)17(19)18-16-13(4)10-12(3)11-14(16)5/h10-11,15H,6-9H2,1-5H3,(H,18,19).
What are the key properties of 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide?
2-propyl-N-(2,4,6-trimethylphenyl)pentanamide has a molecular weight of 261.41 g/mol, XLogP of 4.77, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-N-(2,4,6-trimethylphenyl)pentanamide is sourced from PubChem (CID 11841490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).