N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide

C20H24N2O2 — CID 54826257

IUPACN-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide
SMILESC=C(C)COc1ccccc1NCC(=O)N(CC)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-4-22(17-10-6-5-7-11-17)20(23)14-21-18-12-8-9-13-19(18)24-15-16(2)3/h5-13,21H,2,4,14-15H2,1,3H3
InChIKeyQAQSYKCHDAPORU-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.11
Rot. Bonds8

About N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide

N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide (PubChem CID 54826257) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide.

Molecular Properties

Compound NameN-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide
PubChem CID54826257
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide
SMILESC=C(C)COc1ccccc1NCC(=O)N(CC)c1ccccc1
InChIInChI=1S/C20H24N2O2/c1-4-22(17-10-6-5-7-11-17)20(23)14-21-18-12-8-9-13-19(18)24-15-16(2)3/h5-13,21H,2,4,14-15H2,1,3H3
InChIKeyQAQSYKCHDAPORU-UHFFFAOYSA-N
XLogP4.11
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-4-[[2-[2-(2-methylprop-2-enoxy)anilino]acetyl]amino]-N-phenylbenzamide
CID 54826157
2-(3-acetamido-2-methylanilino)-N-ethyl-N-phenylacetamide
CID 34067816
2-[2-(2-ethoxyethoxy)anilino]-N-[2-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54827379
2-[2-(2-methylprop-2-enoxy)anilino]-N-(1-phenylpropyl)acetamide
CID 54825728
2-(2-cyanoanilino)-N-ethyl-N-phenylacetamide
CID 109007773
N-butyl-2-[2-(2-methylprop-2-enoxy)anilino]acetamide
CID 54825887
2-[2-(2-methylprop-2-enoxy)anilino]-N-(1-phenylethyl)acetamide
CID 54825753
3-(2-ethoxyphenyl)-1-ethyl-1-phenylurea
CID 108991523
N-(2-methoxyphenyl)-2-[2-(2-methylprop-2-enoxy)anilino]acetamide
CID 54826050
2-[2-(2-methylprop-2-enoxy)anilino]-N-(2-phenylmethoxyphenyl)acetamide
CID 54825790
N-ethyl-N-phenyl-2-(quinolin-8-ylamino)acetamide
CID 109007764
N,N-diethyl-2-(2-prop-2-enoxyanilino)acetamide
CID 54824487

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide?
The IUPAC name of N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide (CID 54826257) is N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide.
What is the SMILES notation for N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide?
The canonical SMILES for N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide is C=C(C)COc1ccccc1NCC(=O)N(CC)c1ccccc1.
What is the InChIKey of N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide?
The InChIKey is QAQSYKCHDAPORU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-4-22(17-10-6-5-7-11-17)20(23)14-21-18-12-8-9-13-19(18)24-15-16(2)3/h5-13,21H,2,4,14-15H2,1,3H3.
What are the key properties of N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide?
N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide has a molecular weight of 324.42 g/mol, XLogP of 4.11, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[2-(2-methylprop-2-enoxy)anilino]-N-phenylacetamide is sourced from PubChem (CID 54826257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).