2-(2-ethylphenyl)butanamide

C12H17NO — CID 69466890

IUPAC2-(2-ethylphenyl)butanamide
SMILESCCc1ccccc1C(CC)C(N)=O
InChIInChI=1S/C12H17NO/c1-3-9-7-5-6-8-11(9)10(4-2)12(13)14/h5-8,10H,3-4H2,1-2H3,(H2,13,14)
InChIKeyBCSDILXTLSSMTA-UHFFFAOYSA-N
MW191.27 g/mol
LogP2.23
Rot. Bonds4

About 2-(2-ethylphenyl)butanamide

2-(2-ethylphenyl)butanamide (PubChem CID 69466890) has the molecular formula C12H17NO and a molecular weight of 191.27 g/mol. Its IUPAC name is 2-(2-ethylphenyl)butanamide.

Molecular Properties

Compound Name2-(2-ethylphenyl)butanamide
PubChem CID69466890
Molecular FormulaC12H17NO
Molecular Weight191.27 g/mol
Exact Mass191.13
IUPAC Name2-(2-ethylphenyl)butanamide
SMILESCCc1ccccc1C(CC)C(N)=O
InChIInChI=1S/C12H17NO/c1-3-9-7-5-6-8-11(9)10(4-2)12(13)14/h5-8,10H,3-4H2,1-2H3,(H2,13,14)
InChIKeyBCSDILXTLSSMTA-UHFFFAOYSA-N
XLogP2.23
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.27
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-[2-[chloro(difluoro)methyl]phenyl]butanamide
CID 67505681
(2R)-2-phenylbutanamide
CID 139147476
1-amino-1-(2-ethylphenyl)propan-2-one
CID 55294273
2-[2-(2-trimethylsilylethynyl)phenyl]butanamide
CID 86712268
2-(7-methoxynaphthalen-1-yl)butanamide
CID 57299738
ethyl 2-(2-ethylphenyl)propanoate
CID 105459112
2-(2-ethylphenyl)-2-fluoroacetic acid
CID 105425429
1-bromo-1-(2-ethylphenyl)propan-2-one
CID 130785743
2-(2-chloroanilino)-2-(2-ethylphenyl)acetamide
CID 62416652
ethanol;1-(2-ethylphenyl)ethanol
CID 174807968
1-(2-ethylphenyl)-2-methylpropan-1-amine
CID 55283279
ethyl 3-(2-ethylphenyl)-2,3-dihydroxypropanoate
CID 171865666

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylphenyl)butanamide?
The IUPAC name of 2-(2-ethylphenyl)butanamide (CID 69466890) is 2-(2-ethylphenyl)butanamide.
What is the SMILES notation for 2-(2-ethylphenyl)butanamide?
The canonical SMILES for 2-(2-ethylphenyl)butanamide is CCc1ccccc1C(CC)C(N)=O.
What is the InChIKey of 2-(2-ethylphenyl)butanamide?
The InChIKey is BCSDILXTLSSMTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO/c1-3-9-7-5-6-8-11(9)10(4-2)12(13)14/h5-8,10H,3-4H2,1-2H3,(H2,13,14).
What are the key properties of 2-(2-ethylphenyl)butanamide?
2-(2-ethylphenyl)butanamide has a molecular weight of 191.27 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylphenyl)butanamide is sourced from PubChem (CID 69466890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).