N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide

C15H22Cl2N2O2 — CID 60725471

IUPACN-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide
SMILESCC(C)CC(C)OC(C)C(=O)Nc1c(Cl)cc(N)cc1Cl
InChIInChI=1S/C15H22Cl2N2O2/c1-8(2)5-9(3)21-10(4)15(20)19-14-12(16)6-11(18)7-13(14)17/h6-10H,5,18H2,1-4H3,(H,19,20)
InChIKeyUHRMWPRWYBJSEZ-UHFFFAOYSA-N
MW333.26 g/mol
LogP4.35
Rot. Bonds6

About N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide

N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide (PubChem CID 60725471) has the molecular formula C15H22Cl2N2O2 and a molecular weight of 333.26 g/mol. Its IUPAC name is N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide.

Molecular Properties

Compound NameN-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide
PubChem CID60725471
Molecular FormulaC15H22Cl2N2O2
Molecular Weight333.26 g/mol
Exact Mass332.11
IUPAC NameN-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide
SMILESCC(C)CC(C)OC(C)C(=O)Nc1c(Cl)cc(N)cc1Cl
InChIInChI=1S/C15H22Cl2N2O2/c1-8(2)5-9(3)21-10(4)15(20)19-14-12(16)6-11(18)7-13(14)17/h6-10H,5,18H2,1-4H3,(H,19,20)
InChIKeyUHRMWPRWYBJSEZ-UHFFFAOYSA-N
XLogP4.35
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.26
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-amino-2,6-dichlorophenyl)-2-methoxypropanamide
CID 16782940
N-(4-amino-2,6-dichlorophenyl)-2-(2,2-difluoroethoxy)propanamide
CID 82004014
N-(4-amino-2,6-dichlorophenyl)-2-(3,3-dimethylbutoxy)propanamide
CID 66232439
N-(4-amino-2,6-dichlorophenyl)-2-(2-ethoxyethoxy)propanamide
CID 43093302
N-(4-amino-2-chlorophenyl)-2-butan-2-yloxypropanamide
CID 54943567
2-amino-N-(2,6-dichloro-4-fluorophenyl)-4-methylpentanamide
CID 83079399
N-(4-amino-2,6-dichlorophenyl)-2-pentylsulfanylpropanamide
CID 107748565
N-(4-amino-2,6-dichlorophenyl)-2-propylsulfinylpropanamide
CID 61302841
N-(4-amino-2,6-dichlorophenyl)-2-(2-methylpropylsulfinyl)acetamide
CID 61286801
N-(4-amino-2,6-dichlorophenyl)-2-pyrrolidin-1-ylpropanamide
CID 43080000
N-(4-amino-2,6-dichlorophenyl)-2-[methyl(pentyl)amino]propanamide
CID 43294459
N-(4-amino-2,6-dichlorophenyl)-3-pentan-2-yloxypropanamide
CID 102980723

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide?
The IUPAC name of N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide (CID 60725471) is N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide.
What is the SMILES notation for N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide?
The canonical SMILES for N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide is CC(C)CC(C)OC(C)C(=O)Nc1c(Cl)cc(N)cc1Cl.
What is the InChIKey of N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide?
The InChIKey is UHRMWPRWYBJSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Cl2N2O2/c1-8(2)5-9(3)21-10(4)15(20)19-14-12(16)6-11(18)7-13(14)17/h6-10H,5,18H2,1-4H3,(H,19,20).
What are the key properties of N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide?
N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide has a molecular weight of 333.26 g/mol, XLogP of 4.35, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2,6-dichlorophenyl)-2-(4-methylpentan-2-yloxy)propanamide is sourced from PubChem (CID 60725471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).