3-(7-methoxynaphthalen-1-yl)octanamide

C19H25NO2 — CID 57205091

IUPAC3-(7-methoxynaphthalen-1-yl)octanamide
SMILESCCCCCC(CC(N)=O)c1cccc2ccc(OC)cc12
InChIInChI=1S/C19H25NO2/c1-3-4-5-7-15(12-19(20)21)17-9-6-8-14-10-11-16(22-2)13-18(14)17/h6,8-11,13,15H,3-5,7,12H2,1-2H3,(H2,20,21)
InChIKeySAWRTGUFJGPHQF-UHFFFAOYSA-N
MW299.41 g/mol
LogP4.39
Rot. Bonds8

About 3-(7-methoxynaphthalen-1-yl)octanamide

3-(7-methoxynaphthalen-1-yl)octanamide (PubChem CID 57205091) has the molecular formula C19H25NO2 and a molecular weight of 299.41 g/mol. Its IUPAC name is 3-(7-methoxynaphthalen-1-yl)octanamide.

Molecular Properties

Compound Name3-(7-methoxynaphthalen-1-yl)octanamide
PubChem CID57205091
Molecular FormulaC19H25NO2
Molecular Weight299.41 g/mol
Exact Mass299.19
IUPAC Name3-(7-methoxynaphthalen-1-yl)octanamide
SMILESCCCCCC(CC(N)=O)c1cccc2ccc(OC)cc12
InChIInChI=1S/C19H25NO2/c1-3-4-5-7-15(12-19(20)21)17-9-6-8-14-10-11-16(22-2)13-18(14)17/h6,8-11,13,15H,3-5,7,12H2,1-2H3,(H2,20,21)
InChIKeySAWRTGUFJGPHQF-UHFFFAOYSA-N
XLogP4.39
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.41
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-(7-methoxynaphthalen-1-yl)heptanamide
CID 57192600
2-(7-methoxynaphthalen-1-yl)hexanamide
CID 57317749
3-(7-methoxynaphthalen-1-yl)butanamide
CID 57236760
2-(7-methoxynaphthalen-1-yl)butanamide
CID 57299738
N-[2-(7-methoxynaphthalen-1-yl)-3-sulfanylpropyl]acetamide
CID 72702442
1-tridecan-7-ylanthracene
CID 150514951
1-(7-methoxynaphthalen-1-yl)ethanamine
CID 20542005
5-(7-methoxynaphthalen-1-yl)pentanamide
CID 67627444
5-naphthalen-1-ylheptadecan-2-one
CID 142778100
4-(7-hydroxynaphthalen-1-yl)heptanamide
CID 91045091
[3-acetamido-2-(7-methoxynaphthalen-1-yl)propyl] methanesulfonate
CID 86617345
1-tetracosan-9-ylnaphthalene
CID 175897855

Frequently Asked Questions

What is the IUPAC name of 3-(7-methoxynaphthalen-1-yl)octanamide?
The IUPAC name of 3-(7-methoxynaphthalen-1-yl)octanamide (CID 57205091) is 3-(7-methoxynaphthalen-1-yl)octanamide.
What is the SMILES notation for 3-(7-methoxynaphthalen-1-yl)octanamide?
The canonical SMILES for 3-(7-methoxynaphthalen-1-yl)octanamide is CCCCCC(CC(N)=O)c1cccc2ccc(OC)cc12.
What is the InChIKey of 3-(7-methoxynaphthalen-1-yl)octanamide?
The InChIKey is SAWRTGUFJGPHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO2/c1-3-4-5-7-15(12-19(20)21)17-9-6-8-14-10-11-16(22-2)13-18(14)17/h6,8-11,13,15H,3-5,7,12H2,1-2H3,(H2,20,21).
What are the key properties of 3-(7-methoxynaphthalen-1-yl)octanamide?
3-(7-methoxynaphthalen-1-yl)octanamide has a molecular weight of 299.41 g/mol, XLogP of 4.39, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(7-methoxynaphthalen-1-yl)octanamide is sourced from PubChem (CID 57205091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).