2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide

C20H25NO3 — CID 56728765

IUPAC2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide
SMILESCCc1cc(OC)c(OC)cc1C(=O)NC(CC)c1ccccc1
InChIInChI=1S/C20H25NO3/c1-5-14-12-18(23-3)19(24-4)13-16(14)20(22)21-17(6-2)15-10-8-7-9-11-15/h7-13,17H,5-6H2,1-4H3,(H,21,22)
InChIKeyJNIUVYMGORMJGW-UHFFFAOYSA-N
MW327.42 g/mol
LogP4.15
Rot. Bonds7

About 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide

2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide (PubChem CID 56728765) has the molecular formula C20H25NO3 and a molecular weight of 327.42 g/mol. Its IUPAC name is 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide.

Molecular Properties

Compound Name2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide
PubChem CID56728765
Molecular FormulaC20H25NO3
Molecular Weight327.42 g/mol
Exact Mass327.18
IUPAC Name2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide
SMILESCCc1cc(OC)c(OC)cc1C(=O)NC(CC)c1ccccc1
InChIInChI=1S/C20H25NO3/c1-5-14-12-18(23-3)19(24-4)13-16(14)20(22)21-17(6-2)15-10-8-7-9-11-15/h7-13,17H,5-6H2,1-4H3,(H,21,22)
InChIKeyJNIUVYMGORMJGW-UHFFFAOYSA-N
XLogP4.15
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.42
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,5-dimethoxy-2-methyl-N-(1-phenylpropyl)benzamide
CID 56728755
3-methoxy-N-[(1S)-1-phenylpropyl]naphthalene-2-carboxamide
CID 92675789
2-amino-6-methoxy-N-(1-phenylpropyl)benzamide
CID 81394668
N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide
CID 7311220
3-methoxy-N-[(1R)-1-(4-methoxyphenyl)propyl]naphthalene-2-carboxamide
CID 9115734
N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-phenylethyl]-2-ethyl-4,5-dimethoxybenzamide
CID 56728576
N-(1-phenylpropyl)-2-propan-2-yloxybenzamide
CID 43911562
2-benzylsulfanyl-N-[1-(3,4-dimethoxyphenyl)propyl]benzamide
CID 132666695
N-[(1R)-2-hydroxy-1-phenylethyl]-2-methoxybenzamide
CID 39370043
N-[(1S)-1-(3,4-dimethoxyphenyl)propyl]-2,4,5-trimethylbenzamide
CID 100711328
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
2-(4-methoxy-3-methylphenyl)-N-(1-phenylpropyl)acetamide
CID 133210916

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide?
The IUPAC name of 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide (CID 56728765) is 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide.
What is the SMILES notation for 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide?
The canonical SMILES for 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide is CCc1cc(OC)c(OC)cc1C(=O)NC(CC)c1ccccc1.
What is the InChIKey of 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide?
The InChIKey is JNIUVYMGORMJGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO3/c1-5-14-12-18(23-3)19(24-4)13-16(14)20(22)21-17(6-2)15-10-8-7-9-11-15/h7-13,17H,5-6H2,1-4H3,(H,21,22).
What are the key properties of 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide?
2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide has a molecular weight of 327.42 g/mol, XLogP of 4.15, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4,5-dimethoxy-N-(1-phenylpropyl)benzamide is sourced from PubChem (CID 56728765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).