N-(2-ethylphenyl)-2-methylbutanamide

C13H19NO — CID 3140517

IUPACN-(2-ethylphenyl)-2-methylbutanamide
SMILESCCc1ccccc1NC(=O)C(C)CC
InChIInChI=1S/C13H19NO/c1-4-10(3)13(15)14-12-9-7-6-8-11(12)5-2/h6-10H,4-5H2,1-3H3,(H,14,15)
InChIKeyLPBCMMVCHQDCBE-UHFFFAOYSA-N
MW205.30 g/mol
LogP3.23
Rot. Bonds4

About N-(2-ethylphenyl)-2-methylbutanamide

N-(2-ethylphenyl)-2-methylbutanamide (PubChem CID 3140517) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-(2-ethylphenyl)-2-methylbutanamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-2-methylbutanamide
PubChem CID3140517
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-(2-ethylphenyl)-2-methylbutanamide
SMILESCCc1ccccc1NC(=O)C(C)CC
InChIInChI=1S/C13H19NO/c1-4-10(3)13(15)14-12-9-7-6-8-11(12)5-2/h6-10H,4-5H2,1-3H3,(H,14,15)
InChIKeyLPBCMMVCHQDCBE-UHFFFAOYSA-N
XLogP3.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-methyl-N-[2-[[(S)-methylsulfinyl]methyl]phenyl]butanamide
CID 97306982
2-amino-N-(2-ethylphenyl)-3-methylpentanamide
CID 24700876
N-[2-(1-chloroethyl)phenyl]-2-methylbutanamide
CID 114304941
2-[[(2R)-2-methylbutanoyl]amino]benzoate
CID 6978566
N,N'-bis(2-ethylphenyl)propanediamide
CID 3881876
2-methyl-N-[2-[1-(methylamino)ethyl]phenyl]butanamide
CID 43507938
N-[2-(bromomethyl)phenyl]-2-methylpentanamide
CID 114309617
4-amino-2-ethyl-N-(2-ethylphenyl)butanamide
CID 112515504
N-(2-ethylphenyl)-2-(4-phenylphenoxy)propanamide
CID 19191511
(2S)-2-chloro-N-(2-ethylphenyl)-2-phenylacetamide
CID 40554368
(2R)-2-chloro-N-(2-ethylphenyl)-2-phenylacetamide
CID 40554367
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-2-methylbutanamide?
The IUPAC name of N-(2-ethylphenyl)-2-methylbutanamide (CID 3140517) is N-(2-ethylphenyl)-2-methylbutanamide.
What is the SMILES notation for N-(2-ethylphenyl)-2-methylbutanamide?
The canonical SMILES for N-(2-ethylphenyl)-2-methylbutanamide is CCc1ccccc1NC(=O)C(C)CC.
What is the InChIKey of N-(2-ethylphenyl)-2-methylbutanamide?
The InChIKey is LPBCMMVCHQDCBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-4-10(3)13(15)14-12-9-7-6-8-11(12)5-2/h6-10H,4-5H2,1-3H3,(H,14,15).
What are the key properties of N-(2-ethylphenyl)-2-methylbutanamide?
N-(2-ethylphenyl)-2-methylbutanamide has a molecular weight of 205.30 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-2-methylbutanamide is sourced from PubChem (CID 3140517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).