2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide

C17H26N2O2 — CID 110764588

IUPAC2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
SMILESCc1ccc(C(C)C)cc1C(=O)NCCN1CCOCC1
InChIInChI=1S/C17H26N2O2/c1-13(2)15-5-4-14(3)16(12-15)17(20)18-6-7-19-8-10-21-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20)
InChIKeyVQMKZQFAWKGZJT-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.18
Rot. Bonds5

About 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide

2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide (PubChem CID 110764588) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
PubChem CID110764588
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
SMILESCc1ccc(C(C)C)cc1C(=O)NCCN1CCOCC1
InChIInChI=1S/C17H26N2O2/c1-13(2)15-5-4-14(3)16(12-15)17(20)18-6-7-19-8-10-21-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20)
InChIKeyVQMKZQFAWKGZJT-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
CID 110761441
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)acetamide
CID 110766797
1,2-dimethyl-N-(2-morpholin-4-ylethyl)pyrrole-3-carboxamide
CID 91130996
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide
CID 1354107
2-methyl-N-[2-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 27241616
2-methyl-5-methylsulfonyl-N-(3-morpholin-4-ylpropyl)benzamide
CID 55342252
2-methyl-5-(methylsulfamoyl)-N-(3-morpholin-4-ylpropyl)benzamide
CID 55527296
2-methyl-5-(4-methylpiperidin-1-yl)sulfonyl-N-(2-morpholin-4-ylethyl)benzamide
CID 6471941
N-(3-morpholin-4-ylpropyl)-2-propan-2-ylbenzamide
CID 143519809
1-methyl-N-(2-morpholin-4-ylethyl)-3-propan-2-ylpyrazole-5-carboxamide
CID 70761922
3-iodo-4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 134052243
4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 803484

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
The IUPAC name of 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide (CID 110764588) is 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide.
What is the SMILES notation for 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
The canonical SMILES for 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide is Cc1ccc(C(C)C)cc1C(=O)NCCN1CCOCC1.
What is the InChIKey of 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
The InChIKey is VQMKZQFAWKGZJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(2)15-5-4-14(3)16(12-15)17(20)18-6-7-19-8-10-21-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20).
What are the key properties of 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide has a molecular weight of 290.41 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide is sourced from PubChem (CID 110764588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).