2-(7-methoxynaphthalen-1-yl)hexanamide

C17H21NO2 — CID 57317749

IUPAC2-(7-methoxynaphthalen-1-yl)hexanamide
SMILESCCCCC(C(N)=O)c1cccc2ccc(OC)cc12
InChIInChI=1S/C17H21NO2/c1-3-4-7-15(17(18)19)14-8-5-6-12-9-10-13(20-2)11-16(12)14/h5-6,8-11,15H,3-4,7H2,1-2H3,(H2,18,19)
InChIKeyKFOURLPETAUWQH-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.61
Rot. Bonds6

About 2-(7-methoxynaphthalen-1-yl)hexanamide

2-(7-methoxynaphthalen-1-yl)hexanamide (PubChem CID 57317749) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-(7-methoxynaphthalen-1-yl)hexanamide.

Molecular Properties

Compound Name2-(7-methoxynaphthalen-1-yl)hexanamide
PubChem CID57317749
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name2-(7-methoxynaphthalen-1-yl)hexanamide
SMILESCCCCC(C(N)=O)c1cccc2ccc(OC)cc12
InChIInChI=1S/C17H21NO2/c1-3-4-7-15(17(18)19)14-8-5-6-12-9-10-13(20-2)11-16(12)14/h5-6,8-11,15H,3-4,7H2,1-2H3,(H2,18,19)
InChIKeyKFOURLPETAUWQH-UHFFFAOYSA-N
XLogP3.61
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(7-methoxynaphthalen-1-yl)butanamide
CID 57299738
3-(7-methoxynaphthalen-1-yl)heptanamide
CID 57192600
3-(7-methoxynaphthalen-1-yl)octanamide
CID 57205091
2-(2,3-dimethoxyphenyl)octanamide
CID 139684199
3-(7-methoxynaphthalen-1-yl)butanamide
CID 57236760
1-(7-methoxynaphthalen-1-yl)ethanamine
CID 20542005
2-(2-iodophenyl)hexanamide
CID 141277814
2-naphthalen-1-ylhexanoyl chloride
CID 131880950
N-[2-(7-methoxynaphthalen-1-yl)-3-sulfanylpropyl]acetamide
CID 72702442
(4-methoxyphenyl) 2-methylhexanoate
CID 174280566
3-(7-methoxynaphthalen-1-yl)-2-methylbutan-2-amine
CID 67652493
5-(7-methoxynaphthalen-1-yl)pentanamide
CID 67627444

Frequently Asked Questions

What is the IUPAC name of 2-(7-methoxynaphthalen-1-yl)hexanamide?
The IUPAC name of 2-(7-methoxynaphthalen-1-yl)hexanamide (CID 57317749) is 2-(7-methoxynaphthalen-1-yl)hexanamide.
What is the SMILES notation for 2-(7-methoxynaphthalen-1-yl)hexanamide?
The canonical SMILES for 2-(7-methoxynaphthalen-1-yl)hexanamide is CCCCC(C(N)=O)c1cccc2ccc(OC)cc12.
What is the InChIKey of 2-(7-methoxynaphthalen-1-yl)hexanamide?
The InChIKey is KFOURLPETAUWQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-3-4-7-15(17(18)19)14-8-5-6-12-9-10-13(20-2)11-16(12)14/h5-6,8-11,15H,3-4,7H2,1-2H3,(H2,18,19).
What are the key properties of 2-(7-methoxynaphthalen-1-yl)hexanamide?
2-(7-methoxynaphthalen-1-yl)hexanamide has a molecular weight of 271.36 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-methoxynaphthalen-1-yl)hexanamide is sourced from PubChem (CID 57317749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).