5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide

C14H19ClN2O3 — CID 114775879

IUPAC5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide
SMILESCC1(C)CNCC(COc2ccc(Cl)cc2C(N)=O)O1
InChIInChI=1S/C14H19ClN2O3/c1-14(2)8-17-6-10(20-14)7-19-12-4-3-9(15)5-11(12)13(16)18/h3-5,10,17H,6-8H2,1-2H3,(H2,16,18)
InChIKeyOKSOZKMUZRCPKV-UHFFFAOYSA-N
MW298.77 g/mol
LogP1.58
Rot. Bonds4

About 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide

5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide (PubChem CID 114775879) has the molecular formula C14H19ClN2O3 and a molecular weight of 298.77 g/mol. Its IUPAC name is 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide.

Molecular Properties

Compound Name5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide
PubChem CID114775879
Molecular FormulaC14H19ClN2O3
Molecular Weight298.77 g/mol
Exact Mass298.11
IUPAC Name5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide
SMILESCC1(C)CNCC(COc2ccc(Cl)cc2C(N)=O)O1
InChIInChI=1S/C14H19ClN2O3/c1-14(2)8-17-6-10(20-14)7-19-12-4-3-9(15)5-11(12)13(16)18/h3-5,10,17H,6-8H2,1-2H3,(H2,16,18)
InChIKeyOKSOZKMUZRCPKV-UHFFFAOYSA-N
XLogP1.58
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.77
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(azetidin-3-ylmethoxy)-5-chlorobenzamide
CID 71133700
5-chloro-2-(piperidin-4-ylmethoxy)benzamide
CID 62493382
2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide
CID 114775730
6-[(2-iodo-4-nitrophenoxy)methyl]-2,2-dimethylmorpholine
CID 114775752
N-(3-chlorophenyl)-2-[(6,6-dimethylmorpholin-2-yl)methoxy]acetamide
CID 114775297
2-[(6,6-dimethylmorpholin-2-yl)methoxy]-N-methylbenzenesulfonamide
CID 114775875
6-[(2,6-dichloro-4-nitrophenoxy)methyl]-2,2-dimethylmorpholine
CID 106891998
5-chloro-2-(2-pyrrolidin-3-ylethoxy)benzamide
CID 114796482
5-chloro-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)benzoic acid
CID 102896214
5-chloro-2-[(3S)-piperidin-3-yl]oxybenzamide
CID 66246605
2-[(1-aminocycloheptyl)methoxy]-5-chlorobenzamide
CID 64550004
6-[(4-chloro-1,3-thiazol-2-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775902

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide?
The IUPAC name of 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide (CID 114775879) is 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide.
What is the SMILES notation for 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide?
The canonical SMILES for 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide is CC1(C)CNCC(COc2ccc(Cl)cc2C(N)=O)O1.
What is the InChIKey of 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide?
The InChIKey is OKSOZKMUZRCPKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3/c1-14(2)8-17-6-10(20-14)7-19-12-4-3-9(15)5-11(12)13(16)18/h3-5,10,17H,6-8H2,1-2H3,(H2,16,18).
What are the key properties of 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide?
5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide has a molecular weight of 298.77 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-[(6,6-dimethylmorpholin-2-yl)methoxy]benzamide is sourced from PubChem (CID 114775879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).