N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide

C18H19NO3 — CID 110762005

IUPACN-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide
SMILESCCc1ccc(OC)c(C(=O)Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C18H19NO3/c1-4-13-5-10-17(22-3)16(11-13)18(21)19-15-8-6-14(7-9-15)12(2)20/h5-11H,4H2,1-3H3,(H,19,21)
InChIKeyCWJRDDPIIILMCN-UHFFFAOYSA-N
MW297.35 g/mol
LogP3.71
Rot. Bonds5

About N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide

N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide (PubChem CID 110762005) has the molecular formula C18H19NO3 and a molecular weight of 297.35 g/mol. Its IUPAC name is N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide
PubChem CID110762005
Molecular FormulaC18H19NO3
Molecular Weight297.35 g/mol
Exact Mass297.14
IUPAC NameN-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide
SMILESCCc1ccc(OC)c(C(=O)Nc2ccc(C(C)=O)cc2)c1
InChIInChI=1S/C18H19NO3/c1-4-13-5-10-17(22-3)16(11-13)18(21)19-15-8-6-14(7-9-15)12(2)20/h5-11H,4H2,1-3H3,(H,19,21)
InChIKeyCWJRDDPIIILMCN-UHFFFAOYSA-N
XLogP3.71
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.35
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-[(2-methoxy-5-methylbenzoyl)amino]benzoate
CID 9043924
5-ethyl-2-methoxy-N-propan-2-ylbenzamide
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4-methoxy-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 71608233
2-methoxy-5-methyl-N-[4-(methylaminomethyl)phenyl]benzamide
CID 106910011
N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide
CID 43599944
N-(3-chloro-4-methoxyphenyl)-4-ethylbenzamide
CID 2540642
5-ethyl-2-methoxybenzoic acid
CID 20721149
ethyl 2-[4-[(2-methoxy-5-methylbenzoyl)amino]phenyl]acetate
CID 23453048
N-(4-acetylphenyl)-4-[(4-chlorophenyl)methoxy]-3-methoxybenzamide
CID 2282296
1-N,3-N-bis(4-tert-butylphenyl)-4-methoxybenzene-1,3-dicarboxamide
CID 71761515
2,5-dimethoxy-N-(4-methoxyphenyl)benzamide
CID 8574615
ethane;4-ethyl-2-methoxy-N-pyridin-4-ylbenzamide
CID 167447261

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide?
The IUPAC name of N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide (CID 110762005) is N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide.
What is the SMILES notation for N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide?
The canonical SMILES for N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide is CCc1ccc(OC)c(C(=O)Nc2ccc(C(C)=O)cc2)c1.
What is the InChIKey of N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide?
The InChIKey is CWJRDDPIIILMCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO3/c1-4-13-5-10-17(22-3)16(11-13)18(21)19-15-8-6-14(7-9-15)12(2)20/h5-11H,4H2,1-3H3,(H,19,21).
What are the key properties of N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide?
N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide has a molecular weight of 297.35 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-5-ethyl-2-methoxybenzamide is sourced from PubChem (CID 110762005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).