4-fluoro-N-methyl-2-propoxybenzamide

C11H14FNO2 — CID 176894909

IUPAC4-fluoro-N-methyl-2-propoxybenzamide
SMILESCCCOc1cc(F)ccc1C(=O)NC
InChIInChI=1S/C11H14FNO2/c1-3-6-15-10-7-8(12)4-5-9(10)11(14)13-2/h4-5,7H,3,6H2,1-2H3,(H,13,14)
InChIKeyAFQJDARHLKAXHI-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.97
Rot. Bonds4

About 4-fluoro-N-methyl-2-propoxybenzamide

4-fluoro-N-methyl-2-propoxybenzamide (PubChem CID 176894909) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is 4-fluoro-N-methyl-2-propoxybenzamide.

Molecular Properties

Compound Name4-fluoro-N-methyl-2-propoxybenzamide
PubChem CID176894909
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC Name4-fluoro-N-methyl-2-propoxybenzamide
SMILESCCCOc1cc(F)ccc1C(=O)NC
InChIInChI=1S/C11H14FNO2/c1-3-6-15-10-7-8(12)4-5-9(10)11(14)13-2/h4-5,7H,3,6H2,1-2H3,(H,13,14)
InChIKeyAFQJDARHLKAXHI-UHFFFAOYSA-N
XLogP1.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[5-fluoro-2-(methylcarbamoyl)phenoxy]acetic acid
CID 155801592
4-(2-acetyl-5-fluorophenoxy)-N-methylbutanamide
CID 63891646
1-(5-fluoro-2-propoxyphenyl)propan-1-one
CID 82268324
4-[2-[4-(hydrazinecarbonyl)-3-propoxyphenyl]ethynyl]-2-propoxybenzohydrazide
CID 155213251
2-[2-(ethylcarbamoyl)-5-fluorophenoxy]acetic acid
CID 171396499
2,4-difluoro-N-(4-propoxyphenyl)benzamide
CID 17178087
2-chloro-N-(3,4-dipropoxyphenyl)-4-fluorobenzamide
CID 26878655
(4-fluoro-2-methylphenyl)-(2-propoxyphenyl)methanone
CID 104659409
1-(2-ethoxy-4-fluorophenyl)ethanone
CID 63067474
2-propoxy-N'-(2-propoxybenzoyl)benzohydrazide
CID 4948435
N'-(2,4-difluorobenzoyl)-3-methoxy-4-propoxybenzohydrazide
CID 9440206
1-[2-(2-bromoethoxy)-4-fluorophenyl]ethanone
CID 63069077

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-methyl-2-propoxybenzamide?
The IUPAC name of 4-fluoro-N-methyl-2-propoxybenzamide (CID 176894909) is 4-fluoro-N-methyl-2-propoxybenzamide.
What is the SMILES notation for 4-fluoro-N-methyl-2-propoxybenzamide?
The canonical SMILES for 4-fluoro-N-methyl-2-propoxybenzamide is CCCOc1cc(F)ccc1C(=O)NC.
What is the InChIKey of 4-fluoro-N-methyl-2-propoxybenzamide?
The InChIKey is AFQJDARHLKAXHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c1-3-6-15-10-7-8(12)4-5-9(10)11(14)13-2/h4-5,7H,3,6H2,1-2H3,(H,13,14).
What are the key properties of 4-fluoro-N-methyl-2-propoxybenzamide?
4-fluoro-N-methyl-2-propoxybenzamide has a molecular weight of 211.24 g/mol, XLogP of 1.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-methyl-2-propoxybenzamide is sourced from PubChem (CID 176894909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).