4-(7-methoxynaphthalen-1-yl)butanamide

C15H17NO2 — CID 19752678

IUPAC4-(7-methoxynaphthalen-1-yl)butanamide
SMILESCOc1ccc2cccc(CCCC(N)=O)c2c1
InChIInChI=1S/C15H17NO2/c1-18-13-9-8-12-5-2-4-11(14(12)10-13)6-3-7-15(16)17/h2,4-5,8-10H,3,6-7H2,1H3,(H2,16,17)
InChIKeyQSIOUIPVORSGSV-UHFFFAOYSA-N
MW243.31 g/mol
LogP2.66
Rot. Bonds5

About 4-(7-methoxynaphthalen-1-yl)butanamide

4-(7-methoxynaphthalen-1-yl)butanamide (PubChem CID 19752678) has the molecular formula C15H17NO2 and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-(7-methoxynaphthalen-1-yl)butanamide.

Molecular Properties

Compound Name4-(7-methoxynaphthalen-1-yl)butanamide
PubChem CID19752678
Molecular FormulaC15H17NO2
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Name4-(7-methoxynaphthalen-1-yl)butanamide
SMILESCOc1ccc2cccc(CCCC(N)=O)c2c1
InChIInChI=1S/C15H17NO2/c1-18-13-9-8-12-5-2-4-11(14(12)10-13)6-3-7-15(16)17/h2,4-5,8-10H,3,6-7H2,1H3,(H2,16,17)
InChIKeyQSIOUIPVORSGSV-UHFFFAOYSA-N
XLogP2.66
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Nabumetone
CID 4409
Agomelatine
CID 82148
Naproxen Sodium
CID 23681059
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071631
Butanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071652
N-cyclopropylcarbonyl-2-(7-methoxy-1-naphthyl)ethylamine
CID 164405
Propanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-2-methyl-
CID 3071630
Pentanamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071632
Acetamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-N-methyl-
CID 3071638
Cyclohexanecarboxamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071655
Formamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071657
Cyclobutanecarboxamide, N-(2-(7-methoxy-1-naphthalenyl)ethyl)-
CID 3071658

Frequently Asked Questions

What is the IUPAC name of 4-(7-methoxynaphthalen-1-yl)butanamide?
The IUPAC name of 4-(7-methoxynaphthalen-1-yl)butanamide (CID 19752678) is 4-(7-methoxynaphthalen-1-yl)butanamide.
What is the SMILES notation for 4-(7-methoxynaphthalen-1-yl)butanamide?
The canonical SMILES for 4-(7-methoxynaphthalen-1-yl)butanamide is COc1ccc2cccc(CCCC(N)=O)c2c1.
What is the InChIKey of 4-(7-methoxynaphthalen-1-yl)butanamide?
The InChIKey is QSIOUIPVORSGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2/c1-18-13-9-8-12-5-2-4-11(14(12)10-13)6-3-7-15(16)17/h2,4-5,8-10H,3,6-7H2,1H3,(H2,16,17).
What are the key properties of 4-(7-methoxynaphthalen-1-yl)butanamide?
4-(7-methoxynaphthalen-1-yl)butanamide has a molecular weight of 243.31 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-methoxynaphthalen-1-yl)butanamide is sourced from PubChem (CID 19752678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).