N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide

C19H23NO5 — CID 110783214

IUPACN-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCc2ccc(OC)c(C)c2OC)cc1OC
InChIInChI=1S/C19H23NO5/c1-12-15(22-2)8-7-14(18(12)25-5)11-20-19(21)13-6-9-16(23-3)17(10-13)24-4/h6-10H,11H2,1-5H3,(H,20,21)
InChIKeyFDYRUUIPZSKFIP-UHFFFAOYSA-N
MW345.40 g/mol
LogP2.96
Rot. Bonds7

About N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide

N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide (PubChem CID 110783214) has the molecular formula C19H23NO5 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide.

Molecular Properties

Compound NameN-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide
PubChem CID110783214
Molecular FormulaC19H23NO5
Molecular Weight345.40 g/mol
Exact Mass345.16
IUPAC NameN-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide
SMILESCOc1ccc(C(=O)NCc2ccc(OC)c(C)c2OC)cc1OC
InChIInChI=1S/C19H23NO5/c1-12-15(22-2)8-7-14(18(12)25-5)11-20-19(21)13-6-9-16(23-3)17(10-13)24-4/h6-10H,11H2,1-5H3,(H,20,21)
InChIKeyFDYRUUIPZSKFIP-UHFFFAOYSA-N
XLogP2.96
TPSA66.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-cyano-N-[(2,4-dimethoxy-3-methylphenyl)methyl]acetamide
CID 115173101
N-[(2,4-dimethoxy-3-methylphenyl)methyl]-2-(2-methylphenyl)acetamide
CID 110783236
N-[(2,4-dimethoxy-3-methylphenyl)methyl]furan-2-carboxamide
CID 110783199
1-[(2,4-dimethoxy-3-methylphenyl)methylamino]propan-2-one
CID 115234740
N-[[3-[[(3,4-dimethoxybenzoyl)amino]methyl]phenyl]methyl]-3,4-dimethoxybenzamide
CID 2841934
N-[(2,4-dimethylphenyl)methyl]-3-ethoxy-4-methoxybenzamide
CID 46590873
3-amino-N-[(2,4-dimethoxy-3-methylphenyl)methyl]butanamide
CID 115154202
2-(2,4-dimethoxy-3-methylphenyl)-N'-methylacetohydrazide
CID 116846220
N-[2-(2,4-dimethoxy-3-methylphenyl)ethyl]-3H-benzimidazole-5-carboxamide
CID 110795781
4-methoxy-N-[(2-methoxyphenyl)methyl]-3-methylbenzamide
CID 17018061
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-3,4-dimethoxybenzamide
CID 87043417
3,4-dimethoxy-N-[(2-methyl-1,3-oxazol-4-yl)methyl]benzamide
CID 110714594

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide?
The IUPAC name of N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide (CID 110783214) is N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide.
What is the SMILES notation for N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide?
The canonical SMILES for N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide is COc1ccc(C(=O)NCc2ccc(OC)c(C)c2OC)cc1OC.
What is the InChIKey of N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide?
The InChIKey is FDYRUUIPZSKFIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO5/c1-12-15(22-2)8-7-14(18(12)25-5)11-20-19(21)13-6-9-16(23-3)17(10-13)24-4/h6-10H,11H2,1-5H3,(H,20,21).
What are the key properties of N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide?
N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide has a molecular weight of 345.40 g/mol, XLogP of 2.96, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dimethoxy-3-methylphenyl)methyl]-3,4-dimethoxybenzamide is sourced from PubChem (CID 110783214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).