N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide

C16H23NO2 — CID 113101532

IUPACN-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide
SMILESCCCC(=O)NCCOc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H23NO2/c1-2-5-16(18)17-10-11-19-15-9-8-13-6-3-4-7-14(13)12-15/h8-9,12H,2-7,10-11H2,1H3,(H,17,18)
InChIKeyRCCSYQWMJFRYGX-UHFFFAOYSA-N
MW261.36 g/mol
LogP2.86
Rot. Bonds6

About N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide

N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide (PubChem CID 113101532) has the molecular formula C16H23NO2 and a molecular weight of 261.36 g/mol. Its IUPAC name is N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide.

Molecular Properties

Compound NameN-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide
PubChem CID113101532
Molecular FormulaC16H23NO2
Molecular Weight261.36 g/mol
Exact Mass261.17
IUPAC NameN-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide
SMILESCCCC(=O)NCCOc1ccc2c(c1)CCCC2
InChIInChI=1S/C16H23NO2/c1-2-5-16(18)17-10-11-19-15-9-8-13-6-3-4-7-14(13)12-15/h8-9,12H,2-7,10-11H2,1H3,(H,17,18)
InChIKeyRCCSYQWMJFRYGX-UHFFFAOYSA-N
XLogP2.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.36
LogP ≤ 52.86
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-methyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide
CID 113101536
3-phenyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide
CID 113101565
2-(2,3-dihydro-1H-inden-5-yloxy)-N-[2-(4-ethoxyphenoxy)ethyl]acetamide
CID 9022574
2-(4-methylphenoxy)-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]acetamide
CID 113101573
2,2-dimethyl-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]propanamide
CID 113101539
methyl N-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]carbamate
CID 113101472
2-(4-chlorophenyl)-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]acetamide
CID 113101563
2-(4-bromophenyl)-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]acetamide
CID 113101586
2-(2-methylphenyl)-N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]acetamide
CID 113101580
N-[2-(4-tert-butylphenoxy)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)acetamide
CID 100561035
N-[2-(2,3-dihydro-1H-inden-5-yloxy)ethyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 47064713
1-tert-butyl-3-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]urea
CID 112974906

Frequently Asked Questions

What is the IUPAC name of N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide?
The IUPAC name of N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide (CID 113101532) is N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide.
What is the SMILES notation for N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide?
The canonical SMILES for N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide is CCCC(=O)NCCOc1ccc2c(c1)CCCC2.
What is the InChIKey of N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide?
The InChIKey is RCCSYQWMJFRYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO2/c1-2-5-16(18)17-10-11-19-15-9-8-13-6-3-4-7-14(13)12-15/h8-9,12H,2-7,10-11H2,1H3,(H,17,18).
What are the key properties of N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide?
N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide has a molecular weight of 261.36 g/mol, XLogP of 2.86, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)ethyl]butanamide is sourced from PubChem (CID 113101532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).