N-(3-acetylphenyl)-2-propoxybenzamide

C18H19NO3 — CID 4947871

IUPACN-(3-acetylphenyl)-2-propoxybenzamide
SMILESCCCOc1ccccc1C(=O)Nc1cccc(C(C)=O)c1
InChIInChI=1S/C18H19NO3/c1-3-11-22-17-10-5-4-9-16(17)18(21)19-15-8-6-7-14(12-15)13(2)20/h4-10,12H,3,11H2,1-2H3,(H,19,21)
InChIKeyTYOSDTJWZAOLHY-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.93
Rot. Bonds6

About N-(3-acetylphenyl)-2-propoxybenzamide

N-(3-acetylphenyl)-2-propoxybenzamide (PubChem CID 4947871) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is N-(3-acetylphenyl)-2-propoxybenzamide.

Molecular Properties

Compound NameN-(3-acetylphenyl)-2-propoxybenzamide
PubChem CID4947871
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC NameN-(3-acetylphenyl)-2-propoxybenzamide
SMILESCCCOc1ccccc1C(=O)Nc1cccc(C(C)=O)c1
InChIInChI=1S/C18H19NO3/c1-3-11-22-17-10-5-4-9-16(17)18(21)19-15-8-6-7-14(12-15)13(2)20/h4-10,12H,3,11H2,1-2H3,(H,19,21)
InChIKeyTYOSDTJWZAOLHY-UHFFFAOYSA-N
XLogP3.93
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetylphenyl)-2-ethoxybenzamide
CID 773754
N-[3-(benzylcarbamoyl)phenyl]-2-propoxybenzamide
CID 28638895
2-pentoxy-N-[3-(phenylcarbamoyl)phenyl]benzamide
CID 54781200
N-(3-carbamoylphenyl)-2-pentoxybenzamide
CID 26160536
N-(3-acetamidophenyl)-2-butoxybenzamide
CID 17189815
2-hexoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17233105
N-[(3-acetylphenyl)carbamothioyl]-2-hexoxybenzamide
CID 4942527
N-(3-prop-2-enoxyphenyl)-2-propoxybenzamide
CID 17086740
N-(3-carbamoylphenyl)-2-ethoxybenzamide
CID 25049798
N-[3-(oxolan-2-ylmethylcarbamoyl)phenyl]-2-propoxybenzamide
CID 17202343
2-(2-methylpropoxy)-N-(3-propoxyphenyl)benzamide
CID 17096753
N-[3-(butylcarbamoyl)phenyl]-2-(2-ethoxyethoxy)benzamide
CID 17197044

Frequently Asked Questions

What is the IUPAC name of N-(3-acetylphenyl)-2-propoxybenzamide?
The IUPAC name of N-(3-acetylphenyl)-2-propoxybenzamide (CID 4947871) is N-(3-acetylphenyl)-2-propoxybenzamide.
What is the SMILES notation for N-(3-acetylphenyl)-2-propoxybenzamide?
The canonical SMILES for N-(3-acetylphenyl)-2-propoxybenzamide is CCCOc1ccccc1C(=O)Nc1cccc(C(C)=O)c1.
What is the InChIKey of N-(3-acetylphenyl)-2-propoxybenzamide?
The InChIKey is TYOSDTJWZAOLHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-3-11-22-17-10-5-4-9-16(17)18(21)19-15-8-6-7-14(12-15)13(2)20/h4-10,12H,3,11H2,1-2H3,(H,19,21).
What are the key properties of N-(3-acetylphenyl)-2-propoxybenzamide?
N-(3-acetylphenyl)-2-propoxybenzamide has a molecular weight of 297.35 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetylphenyl)-2-propoxybenzamide is sourced from PubChem (CID 4947871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).