4-[(4-propoxyphenoxy)methyl]benzamide

C17H19NO3 — CID 24605968

IUPAC4-[(4-propoxyphenoxy)methyl]benzamide
SMILESCCCOc1ccc(OCc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C17H19NO3/c1-2-11-20-15-7-9-16(10-8-15)21-12-13-3-5-14(6-4-13)17(18)19/h3-10H,2,11-12H2,1H3,(H2,18,19)
InChIKeyOPDCNXIKNFDVJR-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.15
Rot. Bonds7

About 4-[(4-propoxyphenoxy)methyl]benzamide

4-[(4-propoxyphenoxy)methyl]benzamide (PubChem CID 24605968) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 4-[(4-propoxyphenoxy)methyl]benzamide.

Molecular Properties

Compound Name4-[(4-propoxyphenoxy)methyl]benzamide
PubChem CID24605968
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name4-[(4-propoxyphenoxy)methyl]benzamide
SMILESCCCOc1ccc(OCc2ccc(C(N)=O)cc2)cc1
InChIInChI=1S/C17H19NO3/c1-2-11-20-15-7-9-16(10-8-15)21-12-13-3-5-14(6-4-13)17(18)19/h3-10H,2,11-12H2,1H3,(H2,18,19)
InChIKeyOPDCNXIKNFDVJR-UHFFFAOYSA-N
XLogP3.15
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-propoxyphenyl)benzamide
CID 23771495
4-[[4-(methylamino)phenoxy]methyl]benzamide
CID 54908957
1-[4-[(4-butoxyphenoxy)methyl]phenyl]ethanone
CID 2216486
(4-propoxyphenyl)methyl acetate
CID 150263336
4-[(4-cyanophenoxy)methyl]benzamide
CID 11831905
4-methyl-2-[(4-propoxyphenyl)methoxy]benzamide
CID 75396537
4-[(4-nitrophenyl)methoxy]benzamide
CID 7893395
4-[(4-octoxyphenyl)methoxy]benzoic acid
CID 57070929
1,2-bis(4-propoxyphenyl)ethanone
CID 58229205
propyl 4-[(4-formylphenoxy)methyl]benzoate
CID 23411167
1-phenylmethoxy-4-propoxybenzene
CID 10728874
1-[4-[[4-[(4-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
CID 10619405

Frequently Asked Questions

What is the IUPAC name of 4-[(4-propoxyphenoxy)methyl]benzamide?
The IUPAC name of 4-[(4-propoxyphenoxy)methyl]benzamide (CID 24605968) is 4-[(4-propoxyphenoxy)methyl]benzamide.
What is the SMILES notation for 4-[(4-propoxyphenoxy)methyl]benzamide?
The canonical SMILES for 4-[(4-propoxyphenoxy)methyl]benzamide is CCCOc1ccc(OCc2ccc(C(N)=O)cc2)cc1.
What is the InChIKey of 4-[(4-propoxyphenoxy)methyl]benzamide?
The InChIKey is OPDCNXIKNFDVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-2-11-20-15-7-9-16(10-8-15)21-12-13-3-5-14(6-4-13)17(18)19/h3-10H,2,11-12H2,1H3,(H2,18,19).
What are the key properties of 4-[(4-propoxyphenoxy)methyl]benzamide?
4-[(4-propoxyphenoxy)methyl]benzamide has a molecular weight of 285.34 g/mol, XLogP of 3.15, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-propoxyphenoxy)methyl]benzamide is sourced from PubChem (CID 24605968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).