3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide

C14H19BrN2O2 — CID 110753209

IUPAC3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide
SMILESCN(CCN1CCOCC1)C(=O)c1cccc(Br)c1
InChIInChI=1S/C14H19BrN2O2/c1-16(5-6-17-7-9-19-10-8-17)14(18)12-3-2-4-13(15)11-12/h2-4,11H,5-10H2,1H3
InChIKeyGSWHFHZIMQYLRN-UHFFFAOYSA-N
MW327.22 g/mol
LogP1.85
Rot. Bonds4

About 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide

3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide (PubChem CID 110753209) has the molecular formula C14H19BrN2O2 and a molecular weight of 327.22 g/mol. Its IUPAC name is 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide.

Molecular Properties

Compound Name3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide
PubChem CID110753209
Molecular FormulaC14H19BrN2O2
Molecular Weight327.22 g/mol
Exact Mass326.06
IUPAC Name3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide
SMILESCN(CCN1CCOCC1)C(=O)c1cccc(Br)c1
InChIInChI=1S/C14H19BrN2O2/c1-16(5-6-17-7-9-19-10-8-17)14(18)12-3-2-4-13(15)11-12/h2-4,11H,5-10H2,1H3
InChIKeyGSWHFHZIMQYLRN-UHFFFAOYSA-N
XLogP1.85
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.22
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-iodo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 163865741
3-acetamido-N-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 110752365
3-bromo-N-(2-morpholin-4-ylethyl)benzamide
CID 669309
N-methyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 67379055
3-bromo-N-[2-(dimethylamino)ethyl]-N-methylbenzamide
CID 63695423
3-[(3-bromobenzoyl)-methylamino]propanoic acid
CID 60989178
3-bromo-N-(4-fluoro-1,3-benzothiazol-2-yl)-N-(2-morpholin-4-ylethyl)benzamide
CID 25319351
3-bromo-N-(6-bromo-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide;hydrochloride
CID 44935802
3-bromo-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(3-morpholin-4-ylpropyl)benzamide;hydrochloride
CID 44934292
4-(difluoromethoxy)-N,3,5-trimethyl-N-(2-morpholin-4-ylethyl)benzamide
CID 56783436
1-N-(5-bromo-2-morpholin-4-ylphenyl)-3-N-ethyl-3-N-methylbenzene-1,3-dicarboxamide
CID 167967581
3-chloro-N-methyl-N-(2-piperazin-1-ylethyl)benzamide
CID 63265586

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide?
The IUPAC name of 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide (CID 110753209) is 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide.
What is the SMILES notation for 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide?
The canonical SMILES for 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide is CN(CCN1CCOCC1)C(=O)c1cccc(Br)c1.
What is the InChIKey of 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide?
The InChIKey is GSWHFHZIMQYLRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O2/c1-16(5-6-17-7-9-19-10-8-17)14(18)12-3-2-4-13(15)11-12/h2-4,11H,5-10H2,1H3.
What are the key properties of 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide?
3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide has a molecular weight of 327.22 g/mol, XLogP of 1.85, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-methyl-N-(2-morpholin-4-ylethyl)benzamide is sourced from PubChem (CID 110753209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).