2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide

C14H20Cl2N2O2 — CID 60689184

IUPAC2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide
SMILESCCCCN(CCO)CC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H20Cl2N2O2/c1-2-3-7-18(8-9-19)10-13(20)17-12-6-4-5-11(15)14(12)16/h4-6,19H,2-3,7-10H2,1H3,(H,17,20)
InChIKeyIJIMNCVEXVDEPF-UHFFFAOYSA-N
MW319.23 g/mol
LogP3.03
Rot. Bonds8

About 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide

2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide (PubChem CID 60689184) has the molecular formula C14H20Cl2N2O2 and a molecular weight of 319.23 g/mol. Its IUPAC name is 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide
PubChem CID60689184
Molecular FormulaC14H20Cl2N2O2
Molecular Weight319.23 g/mol
Exact Mass318.09
IUPAC Name2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide
SMILESCCCCN(CCO)CC(=O)Nc1cccc(Cl)c1Cl
InChIInChI=1S/C14H20Cl2N2O2/c1-2-3-7-18(8-9-19)10-13(20)17-12-6-4-5-11(15)14(12)16/h4-6,19H,2-3,7-10H2,1H3,(H,17,20)
InChIKeyIJIMNCVEXVDEPF-UHFFFAOYSA-N
XLogP3.03
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.23
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-2-(dibutylamino)acetamide
CID 18870799
2-[butyl(2-hydroxyethyl)amino]-N-(2-iodophenyl)acetamide
CID 60689127
N-(3-chloro-2-methylphenyl)-2-[2-hydroxyethyl(3-hydroxypropyl)amino]acetamide
CID 111112543
2-[butyl(2-hydroxyethyl)amino]-N-(2-methylphenyl)acetamide
CID 60688995
N-(2,3-dichlorophenyl)-2-[3-hydroxypropyl(methyl)amino]acetamide
CID 114230839
N-(2,6-dichlorophenyl)-2-[2-hydroxyethyl(3-hydroxypropyl)amino]acetamide
CID 111112534
N-(2,3-dichlorophenyl)-2-[ethyl(2-methylprop-2-enyl)amino]acetamide
CID 86976724
2-(dibutylamino)-N-(2,4-dichlorophenyl)acetamide
CID 18870877
2-[butyl(2-hydroxyethyl)amino]-N-(2,4-dibromophenyl)acetamide
CID 60689148
2-(dibutylamino)-N-(2-methylphenyl)acetamide;hydrochloride
CID 3026049
2-[butyl(2-hydroxyethyl)amino]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide
CID 110881535
2-[butyl(2-hydroxyethyl)amino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 60689165

Frequently Asked Questions

What is the IUPAC name of 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide?
The IUPAC name of 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide (CID 60689184) is 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide.
What is the SMILES notation for 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide?
The canonical SMILES for 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide is CCCCN(CCO)CC(=O)Nc1cccc(Cl)c1Cl.
What is the InChIKey of 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide?
The InChIKey is IJIMNCVEXVDEPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Cl2N2O2/c1-2-3-7-18(8-9-19)10-13(20)17-12-6-4-5-11(15)14(12)16/h4-6,19H,2-3,7-10H2,1H3,(H,17,20).
What are the key properties of 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide?
2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide has a molecular weight of 319.23 g/mol, XLogP of 3.03, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(2-hydroxyethyl)amino]-N-(2,3-dichlorophenyl)acetamide is sourced from PubChem (CID 60689184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).