2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide

C14H20N2O — CID 61118628

IUPAC2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)Cc1ccccc1N
InChIInChI=1S/C14H20N2O/c1-4-16(10-11(2)3)14(17)9-12-7-5-6-8-13(12)15/h5-8H,2,4,9-10,15H2,1,3H3
InChIKeyKVOPYSNSKUFVRB-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.24
Rot. Bonds5

About 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide

2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide (PubChem CID 61118628) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide.

Molecular Properties

Compound Name2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
PubChem CID61118628
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide
SMILESC=C(C)CN(CC)C(=O)Cc1ccccc1N
InChIInChI=1S/C14H20N2O/c1-4-16(10-11(2)3)14(17)9-12-7-5-6-8-13(12)15/h5-8H,2,4,9-10,15H2,1,3H3
InChIKeyKVOPYSNSKUFVRB-UHFFFAOYSA-N
XLogP2.24
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N,N-bis(2-amino-2-oxoethyl)-2-(2-aminophenyl)acetamide
CID 55157593
2-(2-aminophenyl)-N,N-dimethylacetamide;hydrochloride
CID 141352115
[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxoethyl] benzoate
CID 55319893
N-ethyl-N-(2-methylprop-2-enyl)-2-phenylsulfanylacetamide
CID 78762330
3-[(2-aminophenyl)methyl]-1,1-diethylurea
CID 79153335
2-[(2-aminophenyl)methylsulfonyl-methylamino]-N,N-diethylacetamide
CID 62020164
2-(2-aminophenyl)-N-ethyl-N-(2-methylphenyl)acetamide
CID 18070776
3-(2-aminophenyl)-N-ethyl-N-propylpropanamide
CID 43309247
2-[2-aminoethyl(benzyl)amino]-N-ethyl-N-(2-methylprop-2-enyl)acetamide
CID 106511560
N-ethyl-N-(2-methylprop-2-enyl)-2-pyridin-2-ylsulfanylacetamide
CID 47095628
3-(2-aminophenyl)-N-(cyclopropylmethyl)-N-ethylpropanamide
CID 63957099
2-(2-aminophenyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-(2-methoxyethyl)acetamide
CID 61107155

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The IUPAC name of 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide (CID 61118628) is 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide.
What is the SMILES notation for 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The canonical SMILES for 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide is C=C(C)CN(CC)C(=O)Cc1ccccc1N.
What is the InChIKey of 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
The InChIKey is KVOPYSNSKUFVRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-4-16(10-11(2)3)14(17)9-12-7-5-6-8-13(12)15/h5-8H,2,4,9-10,15H2,1,3H3.
What are the key properties of 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide?
2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide has a molecular weight of 232.33 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminophenyl)-N-ethyl-N-(2-methylprop-2-enyl)acetamide is sourced from PubChem (CID 61118628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).