2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide

C18H21NO4 — CID 110761096

IUPAC2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCOc1ccc(OC)c(C(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C18H21NO4/c1-12(2)23-14-7-5-13(6-8-14)19-18(20)16-11-15(21-3)9-10-17(16)22-4/h5-12H,1-4H3,(H,19,20)
InChIKeyBLFDXTGGBFJAPI-UHFFFAOYSA-N
MW315.37 g/mol
LogP3.74
Rot. Bonds6

About 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide

2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide (PubChem CID 110761096) has the molecular formula C18H21NO4 and a molecular weight of 315.37 g/mol. Its IUPAC name is 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide.

Molecular Properties

Compound Name2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
PubChem CID110761096
Molecular FormulaC18H21NO4
Molecular Weight315.37 g/mol
Exact Mass315.15
IUPAC Name2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide
SMILESCOc1ccc(OC)c(C(=O)Nc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C18H21NO4/c1-12(2)23-14-7-5-13(6-8-14)19-18(20)16-11-15(21-3)9-10-17(16)22-4/h5-12H,1-4H3,(H,19,20)
InChIKeyBLFDXTGGBFJAPI-UHFFFAOYSA-N
XLogP3.74
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.37
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethoxy-N-(4-methoxyphenyl)benzamide
CID 8574615
N-(4-hydroxyphenyl)-2,5-dimethoxybenzamide
CID 48824493
2-bromo-5-methoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 55749089
2,5-dimethoxy-N-[4-(trifluoromethoxy)phenyl]benzamide
CID 8621705
2-chloro-N-[4-[(5-chloro-2-methoxybenzoyl)amino]phenyl]-5-methoxybenzamide
CID 4077998
4-methoxy-1-N,3-N-bis(4-methoxyphenyl)benzene-1,3-dicarboxamide
CID 71608233
N-(3-bromo-4-fluorophenyl)-2,5-dimethoxybenzamide
CID 115661440
3-amino-4-methoxy-N-(4-propan-2-yloxyphenyl)benzamide
CID 39423304
5,6-dimethoxy-N-(4-propan-2-yloxyphenyl)-1H-indole-3-carboxamide
CID 113206992
N-(4-methoxyphenyl)-5-nitro-2-propan-2-yloxybenzamide
CID 139678187
1-(3-chloro-4-methoxyphenyl)-3-(4-propan-2-yloxyphenyl)urea
CID 108991931
N-[4-[(1R)-1-hydroxyethyl]phenyl]-2,4-dimethoxybenzamide
CID 100803459

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide?
The IUPAC name of 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide (CID 110761096) is 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide.
What is the SMILES notation for 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide?
The canonical SMILES for 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide is COc1ccc(OC)c(C(=O)Nc2ccc(OC(C)C)cc2)c1.
What is the InChIKey of 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide?
The InChIKey is BLFDXTGGBFJAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO4/c1-12(2)23-14-7-5-13(6-8-14)19-18(20)16-11-15(21-3)9-10-17(16)22-4/h5-12H,1-4H3,(H,19,20).
What are the key properties of 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide?
2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide has a molecular weight of 315.37 g/mol, XLogP of 3.74, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethoxy-N-(4-propan-2-yloxyphenyl)benzamide is sourced from PubChem (CID 110761096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).