N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide

C14H21ClN2O — CID 115592340

IUPACN-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide
SMILESCCC(CC)CNCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H21ClN2O/c1-3-11(4-2)9-16-10-14(18)17-13-7-5-12(15)6-8-13/h5-8,11,16H,3-4,9-10H2,1-2H3,(H,17,18)
InChIKeyFFTDWTPCDNQJAS-UHFFFAOYSA-N
MW268.79 g/mol
LogP3.30
Rot. Bonds7

About N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide

N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide (PubChem CID 115592340) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide
PubChem CID115592340
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC NameN-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide
SMILESCCC(CC)CNCC(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H21ClN2O/c1-3-11(4-2)9-16-10-14(18)17-13-7-5-12(15)6-8-13/h5-8,11,16H,3-4,9-10H2,1-2H3,(H,17,18)
InChIKeyFFTDWTPCDNQJAS-UHFFFAOYSA-N
XLogP3.30
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-2-[(3-methyl-2-propan-2-ylbutyl)amino]acetamide
CID 102905399
2-(butan-2-ylamino)-N-(4-chlorophenyl)acetamide
CID 43179385
N-(4-chlorophenyl)-2-[(2-hydroxy-2-phenylethyl)amino]acetamide
CID 43389783
N-(4-chlorophenyl)-2-[(1-ethylcyclopropyl)methylamino]acetamide
CID 114099958
N-(4-chlorophenyl)-2-(2,2-dimethylbutylamino)acetamide
CID 103698697
2-[2-(4-chlorophenyl)ethylamino]-N-(4-ethylphenyl)acetamide
CID 109002843
N-(4-chlorophenyl)-2-[[2-ethyl-2-(hydroxymethyl)butyl]amino]acetamide
CID 106256392
N-(5-chloro-2-methylphenyl)-2-(2-ethylhexylamino)acetamide
CID 103601419
2-[(3-ethyl-2-hydroxypentyl)amino]-N-(4-methylphenyl)acetamide
CID 106285628
N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426
N-(4-chlorophenyl)-2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]acetamide
CID 9336008
2-[[2-(4-chloroanilino)-2-oxoethyl]amino]pentanoic acid
CID 43631680

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide (CID 115592340) is N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide is CCC(CC)CNCC(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide?
The InChIKey is FFTDWTPCDNQJAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2O/c1-3-11(4-2)9-16-10-14(18)17-13-7-5-12(15)6-8-13/h5-8,11,16H,3-4,9-10H2,1-2H3,(H,17,18).
What are the key properties of N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide?
N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide has a molecular weight of 268.79 g/mol, XLogP of 3.30, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(2-ethylbutylamino)acetamide is sourced from PubChem (CID 115592340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).