2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide

C16H23FN2O2 — CID 103603318

IUPAC2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide
SMILESCOc1ccc(C(=O)NC2CCN(C(C)C)CC2)c(F)c1
InChIInChI=1S/C16H23FN2O2/c1-11(2)19-8-6-12(7-9-19)18-16(20)14-5-4-13(21-3)10-15(14)17/h4-5,10-12H,6-9H2,1-3H3,(H,18,20)
InChIKeyFLORGWUXTUTYOE-UHFFFAOYSA-N
MW294.37 g/mol
LogP2.44
Rot. Bonds4

About 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide

2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide (PubChem CID 103603318) has the molecular formula C16H23FN2O2 and a molecular weight of 294.37 g/mol. Its IUPAC name is 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide.

Molecular Properties

Compound Name2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide
PubChem CID103603318
Molecular FormulaC16H23FN2O2
Molecular Weight294.37 g/mol
Exact Mass294.17
IUPAC Name2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide
SMILESCOc1ccc(C(=O)NC2CCN(C(C)C)CC2)c(F)c1
InChIInChI=1S/C16H23FN2O2/c1-11(2)19-8-6-12(7-9-19)18-16(20)14-5-4-13(21-3)10-15(14)17/h4-5,10-12H,6-9H2,1-3H3,(H,18,20)
InChIKeyFLORGWUXTUTYOE-UHFFFAOYSA-N
XLogP2.44
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.37
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-4-methoxy-N-(1-propylpiperidin-4-yl)benzamide
CID 103603316
N-(4-bromocyclohexyl)-2-fluoro-4-methoxybenzamide
CID 102885227
2-bromo-4-fluoro-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 51219889
2-chloro-4,5-difluoro-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 17173512
[(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 2-fluoro-4-methoxybenzoate
CID 7887835
N-(4-aminocyclohexyl)-2-fluoro-4-(2-fluoro-4-methoxyphenyl)benzamide
CID 119476668
2-fluoro-4-methoxy-N-(3-tricyclo[3.2.1.02,4]octanyl)benzamide
CID 103767118
2-fluoro-N-(2-hydroxycyclohexyl)-4-methoxybenzamide
CID 103816699
2,3-dimethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 25236643
2,6-dimethoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 110751950
N-(2-aminocyclopropyl)-2-fluoro-4-methoxybenzamide
CID 103804989
N-cyclopropyl-2,4-dimethoxybenzamide
CID 4576292

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
The IUPAC name of 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide (CID 103603318) is 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide.
What is the SMILES notation for 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
The canonical SMILES for 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide is COc1ccc(C(=O)NC2CCN(C(C)C)CC2)c(F)c1.
What is the InChIKey of 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
The InChIKey is FLORGWUXTUTYOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O2/c1-11(2)19-8-6-12(7-9-19)18-16(20)14-5-4-13(21-3)10-15(14)17/h4-5,10-12H,6-9H2,1-3H3,(H,18,20).
What are the key properties of 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide?
2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide has a molecular weight of 294.37 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methoxy-N-(1-propan-2-ylpiperidin-4-yl)benzamide is sourced from PubChem (CID 103603318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).