2-(3-ethylanilino)-N-propan-2-ylacetamide

C13H20N2O — CID 28584308

IUPAC2-(3-ethylanilino)-N-propan-2-ylacetamide
SMILESCCc1cccc(NCC(=O)NC(C)C)c1
InChIInChI=1S/C13H20N2O/c1-4-11-6-5-7-12(8-11)14-9-13(16)15-10(2)3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyTXCRCPDGZMALTH-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.19
Rot. Bonds5

About 2-(3-ethylanilino)-N-propan-2-ylacetamide

2-(3-ethylanilino)-N-propan-2-ylacetamide (PubChem CID 28584308) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-(3-ethylanilino)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-ethylanilino)-N-propan-2-ylacetamide
PubChem CID28584308
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-(3-ethylanilino)-N-propan-2-ylacetamide
SMILESCCc1cccc(NCC(=O)NC(C)C)c1
InChIInChI=1S/C13H20N2O/c1-4-11-6-5-7-12(8-11)14-9-13(16)15-10(2)3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyTXCRCPDGZMALTH-UHFFFAOYSA-N
XLogP2.19
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethylanilino)-N-(3-methylbutan-2-yl)acetamide
CID 60688155
2-(3-ethylanilino)-N-pentan-2-ylacetamide
CID 60688098
2-(3-ethylanilino)-N-(3-methylbutyl)acetamide
CID 60672205
2-(4-ethylanilino)-N-propan-2-ylacetamide
CID 28583181
2-(3-iodoanilino)-N-propan-2-ylacetamide
CID 28829975
methyl 3-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]benzoate
CID 108992868
N-(cyclopropylmethyl)-2-(3-ethylanilino)acetamide
CID 28584355
N-propan-2-yl-2-[3-(trifluoromethoxy)anilino]acetamide
CID 28586045
N-butan-2-yl-3-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]benzamide
CID 54835244
2-(3-ethyl-4-methylanilino)-N-propan-2-ylacetamide
CID 114250238
2-(3-ethylanilino)-N-(2-fluorophenyl)acetamide
CID 28584361
2-(3,4-difluoroanilino)-N-(3-ethylphenyl)acetamide
CID 112799800

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylanilino)-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-ethylanilino)-N-propan-2-ylacetamide (CID 28584308) is 2-(3-ethylanilino)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-ethylanilino)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-ethylanilino)-N-propan-2-ylacetamide is CCc1cccc(NCC(=O)NC(C)C)c1.
What is the InChIKey of 2-(3-ethylanilino)-N-propan-2-ylacetamide?
The InChIKey is TXCRCPDGZMALTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-4-11-6-5-7-12(8-11)14-9-13(16)15-10(2)3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16).
What are the key properties of 2-(3-ethylanilino)-N-propan-2-ylacetamide?
2-(3-ethylanilino)-N-propan-2-ylacetamide has a molecular weight of 220.32 g/mol, XLogP of 2.19, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylanilino)-N-propan-2-ylacetamide is sourced from PubChem (CID 28584308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).