N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide

C14H19BrN2O2 — CID 115178201

IUPACN-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide
SMILESCc1ccc(Br)cc1N(C)C(=O)CC1CNCCO1
InChIInChI=1S/C14H19BrN2O2/c1-10-3-4-11(15)7-13(10)17(2)14(18)8-12-9-16-5-6-19-12/h3-4,7,12,16H,5-6,8-9H2,1-2H3
InChIKeyYQRKOOGMPURBTN-UHFFFAOYSA-N
MW327.22 g/mol
LogP2.10
Rot. Bonds3

About N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide

N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide (PubChem CID 115178201) has the molecular formula C14H19BrN2O2 and a molecular weight of 327.22 g/mol. Its IUPAC name is N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide
PubChem CID115178201
Molecular FormulaC14H19BrN2O2
Molecular Weight327.22 g/mol
Exact Mass326.06
IUPAC NameN-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide
SMILESCc1ccc(Br)cc1N(C)C(=O)CC1CNCCO1
InChIInChI=1S/C14H19BrN2O2/c1-10-3-4-11(15)7-13(10)17(2)14(18)8-12-9-16-5-6-19-12/h3-4,7,12,16H,5-6,8-9H2,1-2H3
InChIKeyYQRKOOGMPURBTN-UHFFFAOYSA-N
XLogP2.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.22
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-bromo-2-methylphenyl)-N-methyl-2-piperidin-3-ylacetamide
CID 115160585
1-(5-bromo-2-methylphenyl)-2-morpholin-2-ylethanone
CID 116919972
N-(5-bromo-2-methylphenyl)-N-methyl-2-pyrrolidin-2-ylacetamide
CID 115160149
N-(3-bromo-4-methylphenyl)-2-morpholin-2-ylacetamide
CID 66427265
N-[(5-bromo-2-methylphenyl)methyl]-N-methyl-2-morpholin-2-ylethanamine
CID 115239238
N-[2-(4-bromophenoxy)ethyl]-N-methyl-2-morpholin-2-ylacetamide;hydrochloride
CID 119684310
N-methyl-N-[(2-methylphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66433193
N-methyl-N-[(3-methylphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66429127
N-methyl-N-[2-(5-methylfuran-2-yl)ethyl]-2-morpholin-2-ylacetamide
CID 115178233
N-(5-bromo-2-methylphenyl)-3-hydroxy-N-methylpropanamide
CID 115138927
N-methyl-2-morpholin-2-yl-N-propan-2-ylacetamide
CID 66434341
N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119717401

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide?
The IUPAC name of N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide (CID 115178201) is N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide is Cc1ccc(Br)cc1N(C)C(=O)CC1CNCCO1.
What is the InChIKey of N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide?
The InChIKey is YQRKOOGMPURBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O2/c1-10-3-4-11(15)7-13(10)17(2)14(18)8-12-9-16-5-6-19-12/h3-4,7,12,16H,5-6,8-9H2,1-2H3.
What are the key properties of N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide?
N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide has a molecular weight of 327.22 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide is sourced from PubChem (CID 115178201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).