N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide

C12H16Cl2N2O — CID 108993299

IUPACN-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide
SMILESCC(C)CNCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-8(2)6-15-7-12(17)16-11-5-9(13)3-4-10(11)14/h3-5,8,15H,6-7H2,1-2H3,(H,16,17)
InChIKeyQUVFCNGCSOOEQD-UHFFFAOYSA-N
MW275.18 g/mol
LogP3.18
Rot. Bonds5

About N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide

N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide (PubChem CID 108993299) has the molecular formula C12H16Cl2N2O and a molecular weight of 275.18 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide
PubChem CID108993299
Molecular FormulaC12H16Cl2N2O
Molecular Weight275.18 g/mol
Exact Mass274.06
IUPAC NameN-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide
SMILESCC(C)CNCC(=O)Nc1cc(Cl)ccc1Cl
InChIInChI=1S/C12H16Cl2N2O/c1-8(2)6-15-7-12(17)16-11-5-9(13)3-4-10(11)14/h3-5,8,15H,6-7H2,1-2H3,(H,16,17)
InChIKeyQUVFCNGCSOOEQD-UHFFFAOYSA-N
XLogP3.18
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.18
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dichlorophenyl)-3-(2-methylpropylamino)propanamide
CID 109012904
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-2-methylpropanamide
CID 47097183
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-N-(2,5-dichlorophenyl)acetamide
CID 9335626
N-(2,5-dichlorophenyl)-2-methylsulfanylacetamide
CID 47097975
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-2-ethylbutanamide
CID 47097189
(2S)-2-amino-N-[2-(2,5-dichloroanilino)-2-oxoethyl]-3-methylbutanamide;hydrochloride
CID 119268231
2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-(2,5-dichlorophenyl)acetamide
CID 9306788
N-(2,5-dichlorophenyl)-2-(3,5-dimethylanilino)acetamide
CID 54813314
5-(2,5-dichloroanilino)-3-methyl-5-oxopentanoic acid
CID 62964001
2-(1-aminopropan-2-ylsulfanyl)-N-(2,5-dichlorophenyl)acetamide
CID 66220583
3-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]amino]-2-hydroxypropanamide
CID 106174844
N-(5-chloro-2-methylphenyl)-2-(5-methylhexylamino)acetamide
CID 115325803

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide (CID 108993299) is N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide is CC(C)CNCC(=O)Nc1cc(Cl)ccc1Cl.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide?
The InChIKey is QUVFCNGCSOOEQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16Cl2N2O/c1-8(2)6-15-7-12(17)16-11-5-9(13)3-4-10(11)14/h3-5,8,15H,6-7H2,1-2H3,(H,16,17).
What are the key properties of N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide?
N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide has a molecular weight of 275.18 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(2-methylpropylamino)acetamide is sourced from PubChem (CID 108993299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).