5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide

C14H18FNO3 — CID 103739156

IUPAC5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide
SMILESO=C(NCC1CCCC(O)C1)c1cc(F)ccc1O
InChIInChI=1S/C14H18FNO3/c15-10-4-5-13(18)12(7-10)14(19)16-8-9-2-1-3-11(17)6-9/h4-5,7,9,11,17-18H,1-3,6,8H2,(H,16,19)
InChIKeyWLQBWZGSQULZMC-UHFFFAOYSA-N
MW267.30 g/mol
LogP1.81
Rot. Bonds3

About 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide

5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide (PubChem CID 103739156) has the molecular formula C14H18FNO3 and a molecular weight of 267.30 g/mol. Its IUPAC name is 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide
PubChem CID103739156
Molecular FormulaC14H18FNO3
Molecular Weight267.30 g/mol
Exact Mass267.13
IUPAC Name5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide
SMILESO=C(NCC1CCCC(O)C1)c1cc(F)ccc1O
InChIInChI=1S/C14H18FNO3/c15-10-4-5-13(18)12(7-10)14(19)16-8-9-2-1-3-11(17)6-9/h4-5,7,9,11,17-18H,1-3,6,8H2,(H,16,19)
InChIKeyWLQBWZGSQULZMC-UHFFFAOYSA-N
XLogP1.81
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.30
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide
CID 103957239
5-fluoro-2-hydroxy-N-[(2-methylcyclopentyl)methyl]benzamide
CID 107418921
4-chloro-2-fluoro-N-[(3-hydroxycyclohexyl)methyl]benzamide
CID 103691203
2-hydroxy-N-[(3-hydroxycyclopentyl)methyl]-5-methylbenzamide
CID 103279879
2-fluoro-N-[(3-hydroxycyclohexyl)methyl]-4-methylbenzamide
CID 103733972
2-amino-4-fluoro-N-[(3-hydroxycyclopentyl)methyl]benzamide
CID 114145929
2,5-dihydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 107724816
2-amino-4-fluoro-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66004255
5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66005764
2-amino-N-[(3-hydroxycyclohexyl)methyl]benzamide
CID 103950315
5-bromo-2-chloro-N-[(3-hydroxycyclohexyl)methyl]benzamide
CID 103690984
N-[(3-aminocyclohexyl)methyl]-2-hydroxy-5-methylbenzamide
CID 106123350

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide?
The IUPAC name of 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide (CID 103739156) is 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide.
What is the SMILES notation for 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide?
The canonical SMILES for 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide is O=C(NCC1CCCC(O)C1)c1cc(F)ccc1O.
What is the InChIKey of 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide?
The InChIKey is WLQBWZGSQULZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO3/c15-10-4-5-13(18)12(7-10)14(19)16-8-9-2-1-3-11(17)6-9/h4-5,7,9,11,17-18H,1-3,6,8H2,(H,16,19).
What are the key properties of 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide?
5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide has a molecular weight of 267.30 g/mol, XLogP of 1.81, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide is sourced from PubChem (CID 103739156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).