N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide

C15H21ClN2O3 — CID 114775297

IUPACN-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide
SMILESCC1(C)CNCC(COCC(=O)Nc2cccc(Cl)c2)O1
InChIInChI=1S/C15H21ClN2O3/c1-15(2)10-17-7-13(21-15)8-20-9-14(19)18-12-5-3-4-11(16)6-12/h3-6,13,17H,7-10H2,1-2H3,(H,18,19)
InChIKeyMWAKWSDEOUHEQE-UHFFFAOYSA-N
MW312.80 g/mol
LogP2.06
Rot. Bonds5

About N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide

N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide (PubChem CID 114775297) has the molecular formula C15H21ClN2O3 and a molecular weight of 312.80 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide
PubChem CID114775297
Molecular FormulaC15H21ClN2O3
Molecular Weight312.80 g/mol
Exact Mass312.12
IUPAC NameN-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide
SMILESCC1(C)CNCC(COCC(=O)Nc2cccc(Cl)c2)O1
InChIInChI=1S/C15H21ClN2O3/c1-15(2)10-17-7-13(21-15)8-20-9-14(19)18-12-5-3-4-11(16)6-12/h3-6,13,17H,7-10H2,1-2H3,(H,18,19)
InChIKeyMWAKWSDEOUHEQE-UHFFFAOYSA-N
XLogP2.06
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.80
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide (CID 114775297) is N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide is CC1(C)CNCC(COCC(=O)Nc2cccc(Cl)c2)O1.
What is the InChIKey of N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide?
The InChIKey is MWAKWSDEOUHEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O3/c1-15(2)10-17-7-13(21-15)8-20-9-14(19)18-12-5-3-4-11(16)6-12/h3-6,13,17H,7-10H2,1-2H3,(H,18,19).
What are the key properties of N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide?
N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide has a molecular weight of 312.80 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide is sourced from PubChem (CID 114775297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).