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

C16H19NO2 — CID 3071631

IUPACN-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1cccc2ccc(OC)cc12
InChIInChI=1S/C16H19NO2/c1-3-16(18)17-10-9-13-6-4-5-12-7-8-14(19-2)11-15(12)13/h4-8,11H,3,9-10H2,1-2H3,(H,17,18)
InChIKeyAGFPIMUSQHDOJP-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.92
Rot. Bonds5

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

N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide (PubChem CID 3071631) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide
PubChem CID3071631
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC NameN-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1cccc2ccc(OC)cc12
InChIInChI=1S/C16H19NO2/c1-3-16(18)17-10-9-13-6-4-5-12-7-8-14(19-2)11-15(12)13/h4-8,11H,3,9-10H2,1-2H3,(H,17,18)
InChIKeyAGFPIMUSQHDOJP-UHFFFAOYSA-N
XLogP2.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.92
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]propanamide?
The IUPAC name of N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide (CID 3071631) is N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide.
What is the SMILES notation for N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide?
The canonical SMILES for N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide is CCC(=O)NCCc1cccc2ccc(OC)cc12.
What is the InChIKey of N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide?
The InChIKey is AGFPIMUSQHDOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c1-3-16(18)17-10-9-13-6-4-5-12-7-8-14(19-2)11-15(12)13/h4-8,11H,3,9-10H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide?
N-[2-(7-methoxynaphthalen-1-yl)ethyl]propanamide has a molecular weight of 257.33 g/mol, XLogP of 2.92, 5 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]propanamide is sourced from PubChem (CID 3071631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).