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

C17H26N2O3 — CID 110761441

IUPAC2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
SMILESCOc1ccc(C(C)C)cc1C(=O)NCCN1CCOCC1
InChIInChI=1S/C17H26N2O3/c1-13(2)14-4-5-16(21-3)15(12-14)17(20)18-6-7-19-8-10-22-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20)
InChIKeyAZACHTGSMNWHSJ-UHFFFAOYSA-N
MW306.41 g/mol
LogP1.88
Rot. Bonds6

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

2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide (PubChem CID 110761441) has the molecular formula C17H26N2O3 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide.

Molecular Properties

Compound Name2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
PubChem CID110761441
Molecular FormulaC17H26N2O3
Molecular Weight306.41 g/mol
Exact Mass306.19
IUPAC Name2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
SMILESCOc1ccc(C(C)C)cc1C(=O)NCCN1CCOCC1
InChIInChI=1S/C17H26N2O3/c1-13(2)14-4-5-16(21-3)15(12-14)17(20)18-6-7-19-8-10-22-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20)
InChIKeyAZACHTGSMNWHSJ-UHFFFAOYSA-N
XLogP1.88
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide
CID 110764588
2,5-dimethoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 51072890
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)acetamide
CID 110766797
3-methoxy-N-(3-morpholin-4-ylpropyl)naphthalene-2-carboxamide
CID 17462757
2-(difluoromethoxy)-4-methoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 119045783
2-methoxy-6-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 131898398
2-methoxy-5-[methyl(methylsulfonyl)amino]-N-(3-morpholin-4-ylpropyl)benzamide
CID 30148719
2-fluoro-4-(4-methoxyphenyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 154794863
4-butoxy-3-methoxy-N-(2-morpholin-4-ylethyl)benzamide
CID 51159452
2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)butanamide
CID 110316912
4-methoxy-N-(2-morpholin-4-ylethyl)-3-pentoxybenzamide
CID 19363436
N-(2-morpholin-4-ylethyl)-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide
CID 1354107

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
The IUPAC name of 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide (CID 110761441) is 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide.
What is the SMILES notation for 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
The canonical SMILES for 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide is COc1ccc(C(C)C)cc1C(=O)NCCN1CCOCC1.
What is the InChIKey of 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
The InChIKey is AZACHTGSMNWHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3/c1-13(2)14-4-5-16(21-3)15(12-14)17(20)18-6-7-19-8-10-22-11-9-19/h4-5,12-13H,6-11H2,1-3H3,(H,18,20).
What are the key properties of 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide?
2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide has a molecular weight of 306.41 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-morpholin-4-ylethyl)-5-propan-2-ylbenzamide is sourced from PubChem (CID 110761441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).