N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide

C16H24N2O3 — CID 115708011

IUPACN-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide
SMILESCOCCNC(=O)CNC1CCCc2cc(OC)ccc21
InChIInChI=1S/C16H24N2O3/c1-20-9-8-17-16(19)11-18-15-5-3-4-12-10-13(21-2)6-7-14(12)15/h6-7,10,15,18H,3-5,8-9,11H2,1-2H3,(H,17,19)
InChIKeyBLORMTIIKUYFSI-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.42
Rot. Bonds7

About N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide

N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide (PubChem CID 115708011) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide
PubChem CID115708011
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide
SMILESCOCCNC(=O)CNC1CCCc2cc(OC)ccc21
InChIInChI=1S/C16H24N2O3/c1-20-9-8-17-16(19)11-18-15-5-3-4-12-10-13(21-2)6-7-14(12)15/h6-7,10,15,18H,3-5,8-9,11H2,1-2H3,(H,17,19)
InChIKeyBLORMTIIKUYFSI-UHFFFAOYSA-N
XLogP1.42
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide?
The IUPAC name of N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide (CID 115708011) is N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide.
What is the SMILES notation for N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide?
The canonical SMILES for N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide is COCCNC(=O)CNC1CCCc2cc(OC)ccc21.
What is the InChIKey of N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide?
The InChIKey is BLORMTIIKUYFSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-20-9-8-17-16(19)11-18-15-5-3-4-12-10-13(21-2)6-7-14(12)15/h6-7,10,15,18H,3-5,8-9,11H2,1-2H3,(H,17,19).
What are the key properties of N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide?
N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.42, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]acetamide is sourced from PubChem (CID 115708011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).