N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide

C16H19NO3 — CID 19967248

IUPACN-[(7-methoxynaphthalen-1-yl)methoxy]butanamide
SMILESCCCC(=O)NOCc1cccc2ccc(OC)cc12
InChIInChI=1S/C16H19NO3/c1-3-5-16(18)17-20-11-13-7-4-6-12-8-9-14(19-2)10-15(12)13/h4,6-10H,3,5,11H2,1-2H3,(H,17,18)
InChIKeyMONQBFBPGRMIAN-UHFFFAOYSA-N
MW273.33 g/mol
LogP3.20
Rot. Bonds6

About N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide

N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide (PubChem CID 19967248) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide.

Molecular Properties

Compound NameN-[(7-methoxynaphthalen-1-yl)methoxy]butanamide
PubChem CID19967248
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC NameN-[(7-methoxynaphthalen-1-yl)methoxy]butanamide
SMILESCCCC(=O)NOCc1cccc2ccc(OC)cc12
InChIInChI=1S/C16H19NO3/c1-3-5-16(18)17-20-11-13-7-4-6-12-8-9-14(19-2)10-15(12)13/h4,6-10H,3,5,11H2,1-2H3,(H,17,18)
InChIKeyMONQBFBPGRMIAN-UHFFFAOYSA-N
XLogP3.20
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071631
Butanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071652
Pentanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071632
N-hydroxy-7-(naphthalen-2-yloxy)heptanamide
CID 16655084
2-Methoxy-alpha,beta-didehydro-agomelatine
CID 71533431
N-[2-(2,7-dimethoxynaphthalen-1-yl)ethyl]acetamide
CID 10265309
N-[2-(2,7-Dimethoxy-naphthalen-1-yl)-ethyl]-propionamide
CID 10016919
O-[(7-Methoxynaphth-1-yl)Methyl]-N-Acetylhydroxylamine
CID 9837740
3-(7-methoxynaphthalen-1-yl)-N-methylpropanamide
CID 19696845
2-(7-Methoxynaphthalen-1-yl)ethylacetamide
CID 19752678
O-[(2-Methoxynaphth-1-yl)Methyl]-N-Acetylhydroxylamine
CID 19967247
3-(7-Methoxy-1-naphthyl)propanamide
CID 44358869

Frequently Asked Questions

What is the IUPAC name of N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide?
The IUPAC name of N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide (CID 19967248) is N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide.
What is the SMILES notation for N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide?
The canonical SMILES for N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide is CCCC(=O)NOCc1cccc2ccc(OC)cc12.
What is the InChIKey of N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide?
The InChIKey is MONQBFBPGRMIAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-3-5-16(18)17-20-11-13-7-4-6-12-8-9-14(19-2)10-15(12)13/h4,6-10H,3,5,11H2,1-2H3,(H,17,18).
What are the key properties of N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide?
N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide has a molecular weight of 273.33 g/mol, XLogP of 3.20, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(7-methoxynaphthalen-1-yl)methoxy]butanamide is sourced from PubChem (CID 19967248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).