3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide

C20H24N2O5 — CID 6459943

IUPAC3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide
SMILESCOc1cc(NC(=O)c2ccc(OC)c(OC)c2)ccc1NC(=O)C(C)C
InChIInChI=1S/C20H24N2O5/c1-12(2)19(23)22-15-8-7-14(11-17(15)26-4)21-20(24)13-6-9-16(25-3)18(10-13)27-5/h6-12H,1-5H3,(H,21,24)(H,22,23)
InChIKeyLBIBPDOOKDSBQL-UHFFFAOYSA-N
MW372.42 g/mol
LogP3.56
Rot. Bonds7

About 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide

3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide (PubChem CID 6459943) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide.

Molecular Properties

Compound Name3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide
PubChem CID6459943
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC Name3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide
SMILESCOc1cc(NC(=O)c2ccc(OC)c(OC)c2)ccc1NC(=O)C(C)C
InChIInChI=1S/C20H24N2O5/c1-12(2)19(23)22-15-8-7-14(11-17(15)26-4)21-20(24)13-6-9-16(25-3)18(10-13)27-5/h6-12H,1-5H3,(H,21,24)(H,22,23)
InChIKeyLBIBPDOOKDSBQL-UHFFFAOYSA-N
XLogP3.56
TPSA85.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3,4-dimethoxyphenyl)-4-methoxy-3-(2-methylpropanoylamino)benzamide
CID 118877995
N-[4-(carbamothioylamino)-2-methoxyphenyl]-2-methylpropanamide
CID 50882114
4-chloro-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-3-nitrobenzamide
CID 3330979
N-[4-[1-(2,4-dimethoxyanilino)-1-oxopropan-2-yl]sulfanylphenyl]-3,4-dimethoxybenzamide
CID 23099692
N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]-2-methylbenzamide
CID 953068
3,4-dimethoxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 110776412
N-[2-methoxy-4-[(2,2,2-trichloroacetyl)amino]phenyl]-2-methylpropanamide
CID 1298914
N-[4-[(Z)-N'-hydroxycarbamimidoyl]-2-methoxyphenyl]-2-methylpropanamide
CID 113460435
4-tert-butyl-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide
CID 3775032
N-(3-chloro-4-methoxyphenyl)-3,4-dimethoxybenzamide
CID 795184
1-N-(3,4-dimethoxyphenyl)-4-N-hydroxybenzene-1,4-dicarboxamide
CID 126493303
N-(3,4-dimethoxyphenyl)-4-fluoro-3-methylbenzamide
CID 63212434

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide?
The IUPAC name of 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide (CID 6459943) is 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide.
What is the SMILES notation for 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide?
The canonical SMILES for 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide is COc1cc(NC(=O)c2ccc(OC)c(OC)c2)ccc1NC(=O)C(C)C.
What is the InChIKey of 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide?
The InChIKey is LBIBPDOOKDSBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-12(2)19(23)22-15-8-7-14(11-17(15)26-4)21-20(24)13-6-9-16(25-3)18(10-13)27-5/h6-12H,1-5H3,(H,21,24)(H,22,23).
What are the key properties of 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide?
3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide has a molecular weight of 372.42 g/mol, XLogP of 3.56, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethoxy-N-[3-methoxy-4-(2-methylpropanoylamino)phenyl]benzamide is sourced from PubChem (CID 6459943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).