N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide

C18H23NO2 — CID 3071632

IUPACN-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1cccc2ccc(OC)cc12
InChIInChI=1S/C18H23NO2/c1-3-4-8-18(20)19-12-11-15-7-5-6-14-9-10-16(21-2)13-17(14)15/h5-7,9-10,13H,3-4,8,11-12H2,1-2H3,(H,19,20)
InChIKeyIDEFUAZXFAWDEB-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.70
Rot. Bonds7

About N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide

N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide (PubChem CID 3071632) has the molecular formula C18H23NO2 and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide.

Molecular Properties

Compound NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide
PubChem CID3071632
Molecular FormulaC18H23NO2
Molecular Weight285.39 g/mol
Exact Mass285.17
IUPAC NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide
SMILESCCCCC(=O)NCCc1cccc2ccc(OC)cc12
InChIInChI=1S/C18H23NO2/c1-3-4-8-18(20)19-12-11-15-7-5-6-14-9-10-16(21-2)13-17(14)15/h5-7,9-10,13H,3-4,8,11-12H2,1-2H3,(H,19,20)
InChIKeyIDEFUAZXFAWDEB-UHFFFAOYSA-N
XLogP3.70
TPSA38.33 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 ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide?
The IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide (CID 3071632) is N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide.
What is the SMILES notation for N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide?
The canonical SMILES for N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide is CCCCC(=O)NCCc1cccc2ccc(OC)cc12.
What is the InChIKey of N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide?
The InChIKey is IDEFUAZXFAWDEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO2/c1-3-4-8-18(20)19-12-11-15-7-5-6-14-9-10-16(21-2)13-17(14)15/h5-7,9-10,13H,3-4,8,11-12H2,1-2H3,(H,19,20).
What are the key properties of N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide?
N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide has a molecular weight of 285.39 g/mol, XLogP of 3.70, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-methoxynaphthalen-1-yl)ethyl]pentanamide is sourced from PubChem (CID 3071632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).