2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide

C19H23NO3 — CID 94011780

IUPAC2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide
SMILESCC[C@H](NC(=O)c1c(OC)cccc1OC)c1ccc(C)cc1
InChIInChI=1S/C19H23NO3/c1-5-15(14-11-9-13(2)10-12-14)20-19(21)18-16(22-3)7-6-8-17(18)23-4/h6-12,15H,5H2,1-4H3,(H,20,21)/t15-/m0/s1
InChIKeyZXASDFRCHRWGIV-HNNXBMFYSA-N
MW313.40 g/mol
LogP3.89
Rot. Bonds6

About 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide

2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide (PubChem CID 94011780) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide
PubChem CID94011780
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC Name2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide
SMILESCC[C@H](NC(=O)c1c(OC)cccc1OC)c1ccc(C)cc1
InChIInChI=1S/C19H23NO3/c1-5-15(14-11-9-13(2)10-12-14)20-19(21)18-16(22-3)7-6-8-17(18)23-4/h6-12,15H,5H2,1-4H3,(H,20,21)/t15-/m0/s1
InChIKeyZXASDFRCHRWGIV-HNNXBMFYSA-N
XLogP3.89
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-methoxyphenyl)-3-[1-(4-methylphenyl)propyl]urea
CID 133204326
2-amino-6-methoxy-N-(1-phenylpropyl)benzamide
CID 81394668
(E)-3-(2-methoxyphenyl)-N-[(1S)-1-(4-methylphenyl)propyl]prop-2-enamide
CID 9297337
N-[1-(4-methylphenyl)propyl]-2-propan-2-yloxybenzamide
CID 132650459
methyl 4-[[(1S)-1-(4-methylphenyl)propyl]carbamoyl]benzoate
CID 9297354
2,4,5-trimethyl-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 100710053
2-(3-methoxyphenyl)-N-[(1S)-1-(4-methylphenyl)propyl]acetamide
CID 25494188
2-methoxy-N-[(1S)-1-(4-methylphenyl)propyl]acetamide
CID 94014639
N-[1-(4-methylphenyl)propyl]-4-phenylbenzamide
CID 17328245
4-(methoxymethyl)-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 8624127
4,5-dimethoxy-2-methyl-N-(1-phenylpropyl)benzamide
CID 56728755
2-(3,4-dimethoxyphenyl)sulfanyl-N-[1-(4-methylphenyl)propyl]acetamide
CID 132761737

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide?
The IUPAC name of 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide (CID 94011780) is 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide?
The canonical SMILES for 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide is CC[C@H](NC(=O)c1c(OC)cccc1OC)c1ccc(C)cc1.
What is the InChIKey of 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide?
The InChIKey is ZXASDFRCHRWGIV-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-5-15(14-11-9-13(2)10-12-14)20-19(21)18-16(22-3)7-6-8-17(18)23-4/h6-12,15H,5H2,1-4H3,(H,20,21)/t15-/m0/s1.
What are the key properties of 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide?
2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide has a molecular weight of 313.40 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-[(1S)-1-(4-methylphenyl)propyl]benzamide is sourced from PubChem (CID 94011780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).