N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide

C18H21NO3 — CID 7311220

IUPACN-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide
SMILESCC[C@@H](NC(=O)c1ccccc1)c1ccc(OC)c(OC)c1
InChIInChI=1S/C18H21NO3/c1-4-15(19-18(20)13-8-6-5-7-9-13)14-10-11-16(21-2)17(12-14)22-3/h5-12,15H,4H2,1-3H3,(H,19,20)/t15-/m1/s1
InChIKeyUGXZKWFUEQBXDM-OAHLLOKOSA-N
MW299.37 g/mol
LogP3.58
Rot. Bonds6

About N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide

N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide (PubChem CID 7311220) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide.

Molecular Properties

Compound NameN-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide
PubChem CID7311220
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide
SMILESCC[C@@H](NC(=O)c1ccccc1)c1ccc(OC)c(OC)c1
InChIInChI=1S/C18H21NO3/c1-4-15(19-18(20)13-8-6-5-7-9-13)14-10-11-16(21-2)17(12-14)22-3/h5-12,15H,4H2,1-3H3,(H,19,20)/t15-/m1/s1
InChIKeyUGXZKWFUEQBXDM-OAHLLOKOSA-N
XLogP3.58
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide
CID 132651370
N-[1-(3,4-dimethoxyphenyl)propyl]-3,4-dimethylbenzamide
CID 133201858
3-chloro-N-[(1S)-1-(3,4-dimethoxyphenyl)propyl]-4-methoxybenzamide
CID 100648795
N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]-2,6-dimethylpyridine-4-carboxamide
CID 99933793
N-[1-(3,4-dimethoxyphenyl)-2-phenylethyl]-4-fluorobenzamide
CID 4318672
N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]-3-(dimethylsulfamoyl)benzamide
CID 100626865
N-[(1S)-1-(3,4-dimethoxyphenyl)propyl]-2,4,5-trimethylbenzamide
CID 100711328
2-benzylsulfanyl-N-[1-(3,4-dimethoxyphenyl)propyl]benzamide
CID 132666695
4-methoxy-N-[1-(4-methoxy-3-methylphenyl)propyl]benzamide
CID 133210902
N-[1-(3,4-dimethoxyphenyl)propyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 133231412
N-[(1R)-1-(3,4-dimethoxyphenyl)-2-phenylethyl]-3-iodobenzamide
CID 97037048
4-iodo-N-[(1S)-1-(4-methoxy-3-methylphenyl)propyl]benzamide
CID 100684625

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide?
The IUPAC name of N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide (CID 7311220) is N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide.
What is the SMILES notation for N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide?
The canonical SMILES for N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide is CC[C@@H](NC(=O)c1ccccc1)c1ccc(OC)c(OC)c1.
What is the InChIKey of N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide?
The InChIKey is UGXZKWFUEQBXDM-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H21NO3/c1-4-15(19-18(20)13-8-6-5-7-9-13)14-10-11-16(21-2)17(12-14)22-3/h5-12,15H,4H2,1-3H3,(H,19,20)/t15-/m1/s1.
What are the key properties of N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide?
N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide has a molecular weight of 299.37 g/mol, XLogP of 3.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(3,4-dimethoxyphenyl)propyl]benzamide is sourced from PubChem (CID 7311220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).