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

C18H23NO2 — CID 57192600

IUPAC3-(7-methoxynaphthalen-1-yl)heptanamide
SMILESCCCCC(CC(N)=O)c1cccc2ccc(OC)cc12
InChIInChI=1S/C18H23NO2/c1-3-4-6-14(11-18(19)20)16-8-5-7-13-9-10-15(21-2)12-17(13)16/h5,7-10,12,14H,3-4,6,11H2,1-2H3,(H2,19,20)
InChIKeyQXJXXQZQCLMUIY-UHFFFAOYSA-N
MW285.39 g/mol
LogP4.00
Rot. Bonds7

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

3-(7-methoxynaphthalen-1-yl)heptanamide (PubChem CID 57192600) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is 3-(7-methoxynaphthalen-1-yl)heptanamide.

Molecular Properties

Compound Name3-(7-methoxynaphthalen-1-yl)heptanamide
PubChem CID57192600
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC Name3-(7-methoxynaphthalen-1-yl)heptanamide
SMILESCCCCC(CC(N)=O)c1cccc2ccc(OC)cc12
InChIInChI=1S/C18H23NO2/c1-3-4-6-14(11-18(19)20)16-8-5-7-13-9-10-15(21-2)12-17(13)16/h5,7-10,12,14H,3-4,6,11H2,1-2H3,(H2,19,20)
InChIKeyQXJXXQZQCLMUIY-UHFFFAOYSA-N
XLogP4.00
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(7-methoxynaphthalen-1-yl)octanamide
CID 57205091
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-(7-methoxynaphthalen-1-yl)ethanamine
CID 20542005
5-(7-methoxynaphthalen-1-yl)pentanamide
CID 67627444
3-phenylheptanamide
CID 91447364
4-(7-hydroxynaphthalen-1-yl)heptanamide
CID 91045091
[3-acetamido-2-(7-methoxynaphthalen-1-yl)propyl] methanesulfonate
CID 86617345
(4-methoxyphenyl) 2-methylhexanoate
CID 174280566
3-(7-methoxynaphthalen-1-yl)-2-methylbutan-2-amine
CID 67652493

Frequently Asked Questions

What is the IUPAC name of 3-(7-methoxynaphthalen-1-yl)heptanamide?
The IUPAC name of 3-(7-methoxynaphthalen-1-yl)heptanamide (CID 57192600) is 3-(7-methoxynaphthalen-1-yl)heptanamide.
What is the SMILES notation for 3-(7-methoxynaphthalen-1-yl)heptanamide?
The canonical SMILES for 3-(7-methoxynaphthalen-1-yl)heptanamide is CCCCC(CC(N)=O)c1cccc2ccc(OC)cc12.
What is the InChIKey of 3-(7-methoxynaphthalen-1-yl)heptanamide?
The InChIKey is QXJXXQZQCLMUIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-3-4-6-14(11-18(19)20)16-8-5-7-13-9-10-15(21-2)12-17(13)16/h5,7-10,12,14H,3-4,6,11H2,1-2H3,(H2,19,20).
What are the key properties of 3-(7-methoxynaphthalen-1-yl)heptanamide?
3-(7-methoxynaphthalen-1-yl)heptanamide has a molecular weight of 285.39 g/mol, XLogP of 4.00, 7 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)heptanamide is sourced from PubChem (CID 57192600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).