4-(5-phenylpentoxy)benzamide

C18H21NO2 — CID 142267536

IUPAC4-(5-phenylpentoxy)benzamide
SMILESNC(=O)c1ccc(OCCCCCc2ccccc2)cc1
InChIInChI=1S/C18H21NO2/c19-18(20)16-10-12-17(13-11-16)21-14-6-2-5-9-15-7-3-1-4-8-15/h1,3-4,7-8,10-13H,2,5-6,9,14H2,(H2,19,20)
InChIKeyXMXYRCQRPUJYKS-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.58
Rot. Bonds8

About 4-(5-phenylpentoxy)benzamide

4-(5-phenylpentoxy)benzamide (PubChem CID 142267536) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is 4-(5-phenylpentoxy)benzamide.

Molecular Properties

Compound Name4-(5-phenylpentoxy)benzamide
PubChem CID142267536
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC Name4-(5-phenylpentoxy)benzamide
SMILESNC(=O)c1ccc(OCCCCCc2ccccc2)cc1
InChIInChI=1S/C18H21NO2/c19-18(20)16-10-12-17(13-11-16)21-14-6-2-5-9-15-7-3-1-4-8-15/h1,3-4,7-8,10-13H,2,5-6,9,14H2,(H2,19,20)
InChIKeyXMXYRCQRPUJYKS-UHFFFAOYSA-N
XLogP3.58
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.58
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

4-(4-phenylbutoxy)benzamide
CID 11963163
4-[4-[5-(3-fluorophenyl)pentoxy]phenyl]benzamide
CID 58276440
2-[4-(5-phenylpentoxy)phenyl]ethanamine
CID 22929603
8-phenyloctyl carbamate
CID 67180735
3-[4-(4-phenylbutoxy)phenyl]benzamide;2,2,2-trifluoroacetic acid
CID 123258613
4-(2-phenylethyl)benzamide
CID 23130460
1,4-bis(6-phenoxyhexyl)benzene
CID 86175301
[4-[8-(4-benzoylphenoxy)octoxy]phenyl]-phenylmethanone
CID 134886756
N-[4-(4-phenylbutoxy)phenyl]acetamide
CID 143188438
dipotassium;1-bromo-4-(4-phenylbutoxy)benzene;carbonate
CID 157345780
prop-2-enyl 4-[2-hydroxy-3-[4-(5-phenylpentoxy)phenoxy]propoxy]benzoate
CID 10917976
1-hexyl-4-(6-phenylhexoxy)benzene
CID 91256527

Frequently Asked Questions

What is the IUPAC name of 4-(5-phenylpentoxy)benzamide?
The IUPAC name of 4-(5-phenylpentoxy)benzamide (CID 142267536) is 4-(5-phenylpentoxy)benzamide.
What is the SMILES notation for 4-(5-phenylpentoxy)benzamide?
The canonical SMILES for 4-(5-phenylpentoxy)benzamide is NC(=O)c1ccc(OCCCCCc2ccccc2)cc1.
What is the InChIKey of 4-(5-phenylpentoxy)benzamide?
The InChIKey is XMXYRCQRPUJYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c19-18(20)16-10-12-17(13-11-16)21-14-6-2-5-9-15-7-3-1-4-8-15/h1,3-4,7-8,10-13H,2,5-6,9,14H2,(H2,19,20).
What are the key properties of 4-(5-phenylpentoxy)benzamide?
4-(5-phenylpentoxy)benzamide has a molecular weight of 283.37 g/mol, XLogP of 3.58, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-phenylpentoxy)benzamide is sourced from PubChem (CID 142267536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).