2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide

C17H17FN2O4 — CID 34366934

IUPAC2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide
SMILESCNC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H17FN2O4/c1-19-17(22)12-8-14(23-2)15(24-3)9-13(12)20-16(21)10-4-6-11(18)7-5-10/h4-9H,1-3H3,(H,19,22)(H,20,21)
InChIKeyDPCVXWPLRVZLBN-UHFFFAOYSA-N
MW332.33 g/mol
LogP2.45
Rot. Bonds5

About 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide

2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide (PubChem CID 34366934) has the molecular formula C17H17FN2O4 and a molecular weight of 332.33 g/mol. Its IUPAC name is 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide.

Molecular Properties

Compound Name2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide
PubChem CID34366934
Molecular FormulaC17H17FN2O4
Molecular Weight332.33 g/mol
Exact Mass332.12
IUPAC Name2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide
SMILESCNC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H17FN2O4/c1-19-17(22)12-8-14(23-2)15(24-3)9-13(12)20-16(21)10-4-6-11(18)7-5-10/h4-9H,1-3H3,(H,19,22)(H,20,21)
InChIKeyDPCVXWPLRVZLBN-UHFFFAOYSA-N
XLogP2.45
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.33
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 2832276
methyl 2-[(3-fluoro-4-methoxybenzoyl)amino]-4,5-dimethoxybenzoate
CID 27845329
methyl 2-[(3,4-difluorobenzoyl)amino]-4,5-dimethoxybenzoate
CID 17428347
N-[4,5-dimethoxy-2-(methylcarbamoyl)phenyl]quinoline-3-carboxamide
CID 142827920
N-(5-chloro-2,4-dimethoxyphenyl)-4-fluorobenzamide
CID 836286
4-chloro-N-(2-fluoro-4,5-dimethoxyphenyl)benzamide
CID 56782948
4-[(4-fluorobenzoyl)amino]-N-(2-methoxyphenyl)benzamide
CID 2677066
4-(difluoromethoxy)-3-methoxy-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 51218194
N-(2,4-difluorophenyl)-3,4-dimethoxybenzamide
CID 966752
N-(4-fluoro-2-methoxyphenyl)-4-sulfanylbenzamide
CID 107025880
2-[[4-(4-fluorophenyl)-4-oxobutanoyl]amino]-4,5-dimethoxybenzoic acid
CID 108795600
2,4,5-trimethoxy-N-[4-(methylcarbamoyl)phenyl]benzamide
CID 4793592

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide?
The IUPAC name of 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide (CID 34366934) is 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide.
What is the SMILES notation for 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide?
The canonical SMILES for 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide is CNC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide?
The InChIKey is DPCVXWPLRVZLBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O4/c1-19-17(22)12-8-14(23-2)15(24-3)9-13(12)20-16(21)10-4-6-11(18)7-5-10/h4-9H,1-3H3,(H,19,22)(H,20,21).
What are the key properties of 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide?
2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide has a molecular weight of 332.33 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorobenzoyl)amino]-4,5-dimethoxy-N-methylbenzamide is sourced from PubChem (CID 34366934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).