N-ethyl-2-(4-iodoanilino)-N-phenylacetamide

C16H17IN2O — CID 54812345

IUPACN-ethyl-2-(4-iodoanilino)-N-phenylacetamide
SMILESCCN(C(=O)CNc1ccc(I)cc1)c1ccccc1
InChIInChI=1S/C16H17IN2O/c1-2-19(15-6-4-3-5-7-15)16(20)12-18-14-10-8-13(17)9-11-14/h3-11,18H,2,12H2,1H3
InChIKeyINJXFCYRXGBWTA-UHFFFAOYSA-N
MW380.23 g/mol
LogP3.76
Rot. Bonds5

About N-ethyl-2-(4-iodoanilino)-N-phenylacetamide

N-ethyl-2-(4-iodoanilino)-N-phenylacetamide (PubChem CID 54812345) has the molecular formula C16H17IN2O and a molecular weight of 380.23 g/mol. Its IUPAC name is N-ethyl-2-(4-iodoanilino)-N-phenylacetamide.

Molecular Properties

Compound NameN-ethyl-2-(4-iodoanilino)-N-phenylacetamide
PubChem CID54812345
Molecular FormulaC16H17IN2O
Molecular Weight380.23 g/mol
Exact Mass380.04
IUPAC NameN-ethyl-2-(4-iodoanilino)-N-phenylacetamide
SMILESCCN(C(=O)CNc1ccc(I)cc1)c1ccccc1
InChIInChI=1S/C16H17IN2O/c1-2-19(15-6-4-3-5-7-15)16(20)12-18-14-10-8-13(17)9-11-14/h3-11,18H,2,12H2,1H3
InChIKeyINJXFCYRXGBWTA-UHFFFAOYSA-N
XLogP3.76
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.23
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-4-[[2-(N-ethylanilino)-2-oxoethyl]amino]benzamide
CID 54832356
2-(3-acetamidoanilino)-N-ethyl-N-phenylacetamide
CID 37176169
2-(4-chloro-3-fluoroanilino)-N-ethyl-N-phenylacetamide
CID 60536225
2-[4-(azepane-1-carbonyl)anilino]-N-ethyl-N-phenylacetamide
CID 54835196
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
3-[[2-(N-ethylanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 37257112
N-[5-[[2-(N-ethylanilino)-2-oxoethyl]amino]-2-methylphenyl]propanamide
CID 54844732
2-[[2-(N-ethylanilino)-2-oxoethyl]amino]-2-methylpropanoic acid
CID 65263468
N-ethyl-3-(4-methylanilino)-N-phenylpropanamide
CID 109034444
3-(4-bromoanilino)-N-ethyl-N-phenylpropanamide
CID 109036445
N-tert-butyl-3-[[2-(N-ethylanilino)-2-oxoethyl]amino]benzamide
CID 54844457
N-[2-(N-ethylanilino)-2-oxoethyl]benzamide
CID 15890379

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(4-iodoanilino)-N-phenylacetamide?
The IUPAC name of N-ethyl-2-(4-iodoanilino)-N-phenylacetamide (CID 54812345) is N-ethyl-2-(4-iodoanilino)-N-phenylacetamide.
What is the SMILES notation for N-ethyl-2-(4-iodoanilino)-N-phenylacetamide?
The canonical SMILES for N-ethyl-2-(4-iodoanilino)-N-phenylacetamide is CCN(C(=O)CNc1ccc(I)cc1)c1ccccc1.
What is the InChIKey of N-ethyl-2-(4-iodoanilino)-N-phenylacetamide?
The InChIKey is INJXFCYRXGBWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17IN2O/c1-2-19(15-6-4-3-5-7-15)16(20)12-18-14-10-8-13(17)9-11-14/h3-11,18H,2,12H2,1H3.
What are the key properties of N-ethyl-2-(4-iodoanilino)-N-phenylacetamide?
N-ethyl-2-(4-iodoanilino)-N-phenylacetamide has a molecular weight of 380.23 g/mol, XLogP of 3.76, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(4-iodoanilino)-N-phenylacetamide is sourced from PubChem (CID 54812345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).