N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide

C17H24N2O3 — CID 91793858

IUPACN-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide
SMILESCOc1ccc2c(c1)CCCC2NC(=O)CN1CCOCC1
InChIInChI=1S/C17H24N2O3/c1-21-14-5-6-15-13(11-14)3-2-4-16(15)18-17(20)12-19-7-9-22-10-8-19/h5-6,11,16H,2-4,7-10,12H2,1H3,(H,18,20)
InChIKeyYIRGTCOIPZOVHW-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.52
Rot. Bonds4

About N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide

N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide (PubChem CID 91793858) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide.

Molecular Properties

Compound NameN-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide
PubChem CID91793858
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide
SMILESCOc1ccc2c(c1)CCCC2NC(=O)CN1CCOCC1
InChIInChI=1S/C17H24N2O3/c1-21-14-5-6-15-13(11-14)3-2-4-16(15)18-17(20)12-19-7-9-22-10-8-19/h5-6,11,16H,2-4,7-10,12H2,1H3,(H,18,20)
InChIKeyYIRGTCOIPZOVHW-UHFFFAOYSA-N
XLogP1.52
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide?
The IUPAC name of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide (CID 91793858) is N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide.
What is the SMILES notation for N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide?
The canonical SMILES for N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide is COc1ccc2c(c1)CCCC2NC(=O)CN1CCOCC1.
What is the InChIKey of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide?
The InChIKey is YIRGTCOIPZOVHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-21-14-5-6-15-13(11-14)3-2-4-16(15)18-17(20)12-19-7-9-22-10-8-19/h5-6,11,16H,2-4,7-10,12H2,1H3,(H,18,20).
What are the key properties of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide?
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide has a molecular weight of 304.39 g/mol, XLogP of 1.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2-morpholin-4-ylacetamide is sourced from PubChem (CID 91793858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).