2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide

C24H25NO5 — CID 71171207

IUPAC2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide
SMILESCOc1cc(OC)c(C(=O)N(c2ccccc2)c2ccc(C)cc2OC)cc1OC
InChIInChI=1S/C24H25NO5/c1-16-11-12-19(21(13-16)28-3)25(17-9-7-6-8-10-17)24(26)18-14-22(29-4)23(30-5)15-20(18)27-2/h6-15H,1-5H3
InChIKeyNOLUAKKADQPUPV-UHFFFAOYSA-N
MW407.47 g/mol
LogP5.01
Rot. Bonds7

About 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide

2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide (PubChem CID 71171207) has the molecular formula C24H25NO5 and a molecular weight of 407.47 g/mol. Its IUPAC name is 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide.

Molecular Properties

Compound Name2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide
PubChem CID71171207
Molecular FormulaC24H25NO5
Molecular Weight407.47 g/mol
Exact Mass407.17
IUPAC Name2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide
SMILESCOc1cc(OC)c(C(=O)N(c2ccccc2)c2ccc(C)cc2OC)cc1OC
InChIInChI=1S/C24H25NO5/c1-16-11-12-19(21(13-16)28-3)25(17-9-7-6-8-10-17)24(26)18-14-22(29-4)23(30-5)15-20(18)27-2/h6-15H,1-5H3
InChIKeyNOLUAKKADQPUPV-UHFFFAOYSA-N
XLogP5.01
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500407.47
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-N-phenylacetamide
CID 101328675
[4-[2-[4-[3-methoxy-4-(N-(2,4,5-trimethoxybenzoyl)anilino)benzoyl]oxyphenyl]ethynyl]phenyl] 3-(hydroxymethyl)-4-(N-[2,4,5-tris(hydroxymethyl)benzoyl]anilino)benzoate
CID 58282526
2-(2-methoxy-4-methylphenoxy)-N-methyl-N-phenylacetamide
CID 78765522
N-(2,4-dimethylphenyl)-N-phenylacetamide
CID 10537956
2,5-dimethoxy-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylbenzamide
CID 43024651
2-methoxy-N,5-dimethylbenzohydrazide
CID 116845575
2-methoxy-N-methyl-N-(4-methyl-2-phenylmethoxyphenyl)benzamide
CID 140987457
1-(3-methoxynaphthalen-2-yl)-1-(4-methylphenyl)urea
CID 70896646
2,5-dimethoxy-N-methyl-N-phenylbenzamide
CID 16849123
2-phenyl-1-(2,4,5-trimethoxyphenyl)ethanone
CID 15228893
(E)-1-(2-methoxy-4-methylphenyl)-3-(2-methoxyphenyl)prop-2-en-1-one
CID 24561832
methyl 2-(diphenylcarbamoyl)benzoate
CID 785922

Frequently Asked Questions

What is the IUPAC name of 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide?
The IUPAC name of 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide (CID 71171207) is 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide.
What is the SMILES notation for 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide?
The canonical SMILES for 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide is COc1cc(OC)c(C(=O)N(c2ccccc2)c2ccc(C)cc2OC)cc1OC.
What is the InChIKey of 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide?
The InChIKey is NOLUAKKADQPUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO5/c1-16-11-12-19(21(13-16)28-3)25(17-9-7-6-8-10-17)24(26)18-14-22(29-4)23(30-5)15-20(18)27-2/h6-15H,1-5H3.
What are the key properties of 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide?
2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide has a molecular weight of 407.47 g/mol, XLogP of 5.01, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,5-trimethoxy-N-(2-methoxy-4-methylphenyl)-N-phenylbenzamide is sourced from PubChem (CID 71171207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).