N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide

C17H21NO2 — CID 163994355

IUPACN-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide
SMILESCCCC(=O)NCCc1ccc(OC)c2ccccc12
InChIInChI=1S/C17H21NO2/c1-3-6-17(19)18-12-11-13-9-10-16(20-2)15-8-5-4-7-14(13)15/h4-5,7-10H,3,6,11-12H2,1-2H3,(H,18,19)
InChIKeyUDJWRXZBHLDLEO-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.31
Rot. Bonds6

About N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide

N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide (PubChem CID 163994355) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide.

Molecular Properties

Compound NameN-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide
PubChem CID163994355
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC NameN-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide
SMILESCCCC(=O)NCCc1ccc(OC)c2ccccc12
InChIInChI=1S/C17H21NO2/c1-3-6-17(19)18-12-11-13-9-10-16(20-2)15-8-5-4-7-14(13)15/h4-5,7-10H,3,6,11-12H2,1-2H3,(H,18,19)
InChIKeyUDJWRXZBHLDLEO-UHFFFAOYSA-N
XLogP3.31
TPSA38.33 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 ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-phenoxyethyl)-3-(2,3,4-trimethoxyphenyl)propanamide
CID 55882512
N-[2-(4-methoxy-2,5-dimethylphenyl)ethyl]butanamide
CID 110788062
4-hydroxy-N-[2-(4-methoxy-2,3-dimethylphenyl)ethyl]butanamide
CID 115163104
3-[(4-methoxynaphthalen-1-yl)methylamino]-N-methylpropanamide
CID 78998463
3-phenyl-N-[(2,3,4-trimethoxyphenyl)methyl]propanamide
CID 46587581
5-fluoro-3-N-[2-(4-methoxynaphthalen-1-yl)ethyl]benzene-1,3-dicarboxamide
CID 166367826
N-benzyl-3-[(2,3,4-trimethoxyphenyl)methylamino]propanamide
CID 51129427
1-(4-methoxynaphthalen-1-yl)propan-2-one
CID 70461266
N-[2-[3-(3,4-dimethoxyphenyl)propanoylamino]ethyl]butanamide
CID 108574268
2-[3-(2,3,4-trimethoxyphenyl)propanoylamino]acetic acid
CID 119171700
N-[2-(2-methoxyphenyl)ethyl]-4-methylpentanamide
CID 78779677
2-[2-(butanoylamino)ethyl]benzamide
CID 66868335

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide?
The IUPAC name of N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide (CID 163994355) is N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide.
What is the SMILES notation for N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide?
The canonical SMILES for N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide is CCCC(=O)NCCc1ccc(OC)c2ccccc12.
What is the InChIKey of N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide?
The InChIKey is UDJWRXZBHLDLEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-3-6-17(19)18-12-11-13-9-10-16(20-2)15-8-5-4-7-14(13)15/h4-5,7-10H,3,6,11-12H2,1-2H3,(H,18,19).
What are the key properties of N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide?
N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide has a molecular weight of 271.36 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxynaphthalen-1-yl)ethyl]butanamide is sourced from PubChem (CID 163994355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).