2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide

C15H20FNO3 — CID 65433466

IUPAC2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)NCC1CCCCC1O
InChIInChI=1S/C15H20FNO3/c1-20-13-8-4-6-11(16)14(13)15(19)17-9-10-5-2-3-7-12(10)18/h4,6,8,10,12,18H,2-3,5,7,9H2,1H3,(H,17,19)
InChIKeyIFXQGHVLFGQNEC-UHFFFAOYSA-N
MW281.33 g/mol
LogP2.12
Rot. Bonds4

About 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide

2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide (PubChem CID 65433466) has the molecular formula C15H20FNO3 and a molecular weight of 281.33 g/mol. Its IUPAC name is 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide.

Molecular Properties

Compound Name2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide
PubChem CID65433466
Molecular FormulaC15H20FNO3
Molecular Weight281.33 g/mol
Exact Mass281.14
IUPAC Name2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide
SMILESCOc1cccc(F)c1C(=O)NCC1CCCCC1O
InChIInChI=1S/C15H20FNO3/c1-20-13-8-4-6-11(16)14(13)15(19)17-9-10-5-2-3-7-12(10)18/h4,6,8,10,12,18H,2-3,5,7,9H2,1H3,(H,17,19)
InChIKeyIFXQGHVLFGQNEC-UHFFFAOYSA-N
XLogP2.12
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-aminocyclohexyl)methyl]-2-fluoro-6-methoxybenzamide
CID 106124687
5-fluoro-N-[(2-hydroxycyclopentyl)methyl]-2-methoxybenzamide
CID 111464236
2-fluoro-6-methoxy-N-(piperidin-3-ylmethyl)benzamide
CID 65433806
N-[2-(cycloheptylamino)ethyl]-2-fluoro-6-methoxybenzamide
CID 119619869
2,3,6-trifluoro-N-[[(1R,2S)-2-hydroxycyclopentyl]methyl]benzamide
CID 99855973
2-fluoro-6-hydroxy-N-[(2-methylcyclohexyl)methyl]benzamide
CID 107015192
3-amino-2,6-difluoro-N-[(2-hydroxycyclohexyl)methyl]benzamide
CID 79773461
methyl 2-[[(2-chloro-6-fluorobenzoyl)amino]methyl]cyclohexane-1-carboxylate
CID 108745251
2,4-difluoro-N-[(2-hydroxycyclohexyl)methyl]benzamide
CID 64928717
3-hydroxy-N-[(2-hydroxycyclohexyl)methyl]-2-methylbenzamide
CID 82828909
N-[(1S,2S)-2-aminocyclopentyl]-2-fluoro-6-methoxybenzamide
CID 118308174
N-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methylbenzamide
CID 70846071

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide?
The IUPAC name of 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide (CID 65433466) is 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide.
What is the SMILES notation for 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide?
The canonical SMILES for 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide is COc1cccc(F)c1C(=O)NCC1CCCCC1O.
What is the InChIKey of 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide?
The InChIKey is IFXQGHVLFGQNEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO3/c1-20-13-8-4-6-11(16)14(13)15(19)17-9-10-5-2-3-7-12(10)18/h4,6,8,10,12,18H,2-3,5,7,9H2,1H3,(H,17,19).
What are the key properties of 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide?
2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide has a molecular weight of 281.33 g/mol, XLogP of 2.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[(2-hydroxycyclohexyl)methyl]-6-methoxybenzamide is sourced from PubChem (CID 65433466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).