N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide

C14H18Cl2N2O — CID 86976724

IUPACN-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide
SMILESC=C(C)CN(CC)CC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H18Cl2N2O/c1-4-18(8-10(2)3)9-13(19)17-12-7-5-6-11(15)14(12)16/h5-7H,2,4,8-9H2,1,3H3,(H,17,19)
InChIKeyYFGDWDLYUSORQL-UHFFFAOYSA-N
MW301.22 g/mol
LogP3.83
Rot. Bonds6

About N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide

N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide (PubChem CID 86976724) has the molecular formula C14H18Cl2N2O and a molecular weight of 301.22 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide
PubChem CID86976724
Molecular FormulaC14H18Cl2N2O
Molecular Weight301.22 g/mol
Exact Mass300.08
IUPAC NameN-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide
SMILESC=C(C)CN(CC)CC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H18Cl2N2O/c1-4-18(8-10(2)3)9-13(19)17-12-7-5-6-11(15)14(12)16/h5-7H,2,4,8-9H2,1,3H3,(H,17,19)
InChIKeyYFGDWDLYUSORQL-UHFFFAOYSA-N
XLogP3.83
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.22
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(2,3-dichlorophenyl)-1,1-diethylurea
CID 4098247
N-(4-bromo-2-chlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide
CID 86913389
N-(2-chlorophenyl)-3-[ethyl(2-methylprop-2-enyl)amino]propanamide;hydrochloride
CID 90483718
N-(2,3-dichlorophenyl)-2-(N-ethylanilino)acetamide
CID 54808631
N-(4-chloro-2-methylphenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide
CID 86976734
2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 60689184
2-[acetyl(propan-2-yl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 113158283
2-[acetyl(cyclopropyl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 113158482
2-[[2-(2,3-dichloroanilino)-2-oxoethyl]-ethylamino]-2-methylpropanoic acid
CID 62821132
N-(2,3-dichlorophenyl)-N',N'-diethyl-2,2-dimethylpropanediamide
CID 108965784
2-[ethyl(2-methylprop-2-enyl)amino]-N-(3-fluorophenyl)acetamide
CID 78787752
2-[azetidin-3-yl(ethyl)amino]-N-(2,3-dichlorophenyl)acetamide
CID 66181735

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide?
The IUPAC name of N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide (CID 86976724) is N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide is C=C(C)CN(CC)CC(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide?
The InChIKey is YFGDWDLYUSORQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N2O/c1-4-18(8-10(2)3)9-13(19)17-12-7-5-6-11(15)14(12)16/h5-7H,2,4,8-9H2,1,3H3,(H,17,19).
What are the key properties of N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide?
N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide has a molecular weight of 301.22 g/mol, XLogP of 3.83, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide is sourced from PubChem (CID 86976724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).