2-ethyl-N-(3-methylphenyl)pentanamide

C14H21NO — CID 20659416

IUPAC2-ethyl-N-(3-methylphenyl)pentanamide
SMILESCCCC(CC)C(=O)Nc1cccc(C)c1
InChIInChI=1S/C14H21NO/c1-4-7-12(5-2)14(16)15-13-9-6-8-11(3)10-13/h6,8-10,12H,4-5,7H2,1-3H3,(H,15,16)
InChIKeyHBCACXUSTZRYNA-UHFFFAOYSA-N
MW219.33 g/mol
LogP3.76
Rot. Bonds5

About 2-ethyl-N-(3-methylphenyl)pentanamide

2-ethyl-N-(3-methylphenyl)pentanamide (PubChem CID 20659416) has the molecular formula C14H21NO and a molecular weight of 219.33 g/mol. Its IUPAC name is 2-ethyl-N-(3-methylphenyl)pentanamide.

Molecular Properties

Compound Name2-ethyl-N-(3-methylphenyl)pentanamide
PubChem CID20659416
Molecular FormulaC14H21NO
Molecular Weight219.33 g/mol
Exact Mass219.16
IUPAC Name2-ethyl-N-(3-methylphenyl)pentanamide
SMILESCCCC(CC)C(=O)Nc1cccc(C)c1
InChIInChI=1S/C14H21NO/c1-4-7-12(5-2)14(16)15-13-9-6-8-11(3)10-13/h6,8-10,12H,4-5,7H2,1-3H3,(H,15,16)
InChIKeyHBCACXUSTZRYNA-UHFFFAOYSA-N
XLogP3.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.33
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-amino-N-(3-methylphenyl)butanamide
CID 43649463
2-[[(3-methylphenyl)carbamoylamino]methyl]pentanoic acid
CID 65217917
2-ethyl-N-(3-ethylphenyl)hexanamide
CID 2930843
N-(3-methylphenyl)-2-(propylamino)propanamide
CID 71772237
(2R)-N-(3-methylphenyl)-2-(propylamino)propanamide
CID 76957051
N-[3-(2,2-dimethylpropanoylamino)phenyl]-2-propylpentanamide
CID 17296409
(2S)-N-(3-methylphenyl)-2-(propylamino)propanamide
CID 76957050
2-ethyl-N-[3-(2-methylpropanoylamino)phenyl]butanamide
CID 21430939
ethane;2-methyl-N-(3-methylphenyl)propanamide
CID 163229096
N-(3-methylphenyl)-2-(pentan-2-ylamino)acetamide
CID 43179547
2-ethyl-N-(2-fluoro-4-methylphenyl)pentanamide
CID 145282464
2-ethyl-N-(3-formylphenyl)hexanamide
CID 54554247

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(3-methylphenyl)pentanamide?
The IUPAC name of 2-ethyl-N-(3-methylphenyl)pentanamide (CID 20659416) is 2-ethyl-N-(3-methylphenyl)pentanamide.
What is the SMILES notation for 2-ethyl-N-(3-methylphenyl)pentanamide?
The canonical SMILES for 2-ethyl-N-(3-methylphenyl)pentanamide is CCCC(CC)C(=O)Nc1cccc(C)c1.
What is the InChIKey of 2-ethyl-N-(3-methylphenyl)pentanamide?
The InChIKey is HBCACXUSTZRYNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO/c1-4-7-12(5-2)14(16)15-13-9-6-8-11(3)10-13/h6,8-10,12H,4-5,7H2,1-3H3,(H,15,16).
What are the key properties of 2-ethyl-N-(3-methylphenyl)pentanamide?
2-ethyl-N-(3-methylphenyl)pentanamide has a molecular weight of 219.33 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(3-methylphenyl)pentanamide is sourced from PubChem (CID 20659416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).