N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide

C16H22Cl2N2O2 — CID 110444241

IUPACN-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide
SMILESCC(C)(CNC(=O)CN1CCOCC1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C16H22Cl2N2O2/c1-16(2,13-4-3-12(17)9-14(13)18)11-19-15(21)10-20-5-7-22-8-6-20/h3-4,9H,5-8,10-11H2,1-2H3,(H,19,21)
InChIKeyMQMLUMGQHAPZIT-UHFFFAOYSA-N
MW345.27 g/mol
LogP2.72
Rot. Bonds5

About N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide

N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide (PubChem CID 110444241) has the molecular formula C16H22Cl2N2O2 and a molecular weight of 345.27 g/mol. Its IUPAC name is N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide
PubChem CID110444241
Molecular FormulaC16H22Cl2N2O2
Molecular Weight345.27 g/mol
Exact Mass344.11
IUPAC NameN-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide
SMILESCC(C)(CNC(=O)CN1CCOCC1)c1ccc(Cl)cc1Cl
InChIInChI=1S/C16H22Cl2N2O2/c1-16(2,13-4-3-12(17)9-14(13)18)11-19-15(21)10-20-5-7-22-8-6-20/h3-4,9H,5-8,10-11H2,1-2H3,(H,19,21)
InChIKeyMQMLUMGQHAPZIT-UHFFFAOYSA-N
XLogP2.72
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.27
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-fluorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide
CID 110444248
5-[[2-(2,4-dichlorophenyl)-2-methylpropyl]amino]-5-oxopentanoic acid
CID 110442654
N-[(Z)-(2,4-dichlorophenyl)methylideneamino]-2-morpholin-4-ylacetamide
CID 5411350
N-[2-(3-chlorophenyl)-2-methylpropyl]-2-(1,1-dioxo-1,4-thiazinan-4-yl)acetamide
CID 47085188
2,4-dichloro-N-(morpholin-4-ylmethyl)aniline
CID 4525296
N-[3-[(4-chlorophenyl)methylsulfanyl]propyl]-2-morpholin-4-ylacetamide
CID 131937242
2-(4-benzylpiperazin-1-yl)-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
CID 46491153
N-(3,5-dichlorophenyl)-2-morpholin-4-ylacetamide
CID 717337
N-[(2,4-dichlorophenyl)methyl]-2-(4-methylpiperazin-1-yl)acetamide
CID 8896722
1-(3-chlorophenyl)-2-morpholin-4-ylethanone
CID 43227690
N-(2-amino-5-chlorophenyl)-2-(1,4-oxazepan-4-yl)acetamide
CID 62987910
N-[3-(4-chlorophenyl)-1-methylpyrazol-5-yl]-2-morpholin-4-ylacetamide
CID 8903865

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide?
The IUPAC name of N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide (CID 110444241) is N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide?
The canonical SMILES for N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide is CC(C)(CNC(=O)CN1CCOCC1)c1ccc(Cl)cc1Cl.
What is the InChIKey of N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide?
The InChIKey is MQMLUMGQHAPZIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22Cl2N2O2/c1-16(2,13-4-3-12(17)9-14(13)18)11-19-15(21)10-20-5-7-22-8-6-20/h3-4,9H,5-8,10-11H2,1-2H3,(H,19,21).
What are the key properties of N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide?
N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide has a molecular weight of 345.27 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dichlorophenyl)-2-methylpropyl]-2-morpholin-4-ylacetamide is sourced from PubChem (CID 110444241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).