5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide

C12H14ClNO3 — CID 66005764

IUPAC5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
SMILESO=C(NCC1CC(O)C1)c1cc(Cl)ccc1O
InChIInChI=1S/C12H14ClNO3/c13-8-1-2-11(16)10(5-8)12(17)14-6-7-3-9(15)4-7/h1-2,5,7,9,15-16H,3-4,6H2,(H,14,17)
InChIKeyNWJOYAVYPYRANW-UHFFFAOYSA-N
MW255.70 g/mol
LogP1.55
Rot. Bonds3

About 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide

5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide (PubChem CID 66005764) has the molecular formula C12H14ClNO3 and a molecular weight of 255.70 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
PubChem CID66005764
Molecular FormulaC12H14ClNO3
Molecular Weight255.70 g/mol
Exact Mass255.07
IUPAC Name5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
SMILESO=C(NCC1CC(O)C1)c1cc(Cl)ccc1O
InChIInChI=1S/C12H14ClNO3/c13-8-1-2-11(16)10(5-8)12(17)14-6-7-3-9(15)4-7/h1-2,5,7,9,15-16H,3-4,6H2,(H,14,17)
InChIKeyNWJOYAVYPYRANW-UHFFFAOYSA-N
XLogP1.55
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 51.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-fluoro-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66004553
2,5-dihydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 107724816
N-(2-bicyclo[2.2.1]heptanylmethyl)-5-chloro-2-hydroxybenzamide
CID 55232835
4-bromo-2-chloro-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 66006638
5-chloro-2-fluoro-N-[(4-hydroxycyclohexyl)methyl]benzamide
CID 114146514
2-hydroxy-N-[(3-hydroxycyclopentyl)methyl]-5-methylbenzamide
CID 103279879
2-fluoro-6-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide
CID 107015730
2-[(5-chloro-2-hydroxybenzoyl)amino]acetic acid
CID 15858288
5-fluoro-2-hydroxy-N-[(3-hydroxycyclohexyl)methyl]benzamide
CID 103739156
4-chloro-2-fluoro-N-[(3-hydroxycyclohexyl)methyl]benzamide
CID 103691203
2,6-dichloro-N-[(3-hydroxycyclobutyl)methyl]pyridine-4-carboxamide
CID 66004828
5-chloro-N-(2-ethylbutyl)-2-hydroxybenzamide
CID 115613546

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide (CID 66005764) is 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide is O=C(NCC1CC(O)C1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
The InChIKey is NWJOYAVYPYRANW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClNO3/c13-8-1-2-11(16)10(5-8)12(17)14-6-7-3-9(15)4-7/h1-2,5,7,9,15-16H,3-4,6H2,(H,14,17).
What are the key properties of 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide?
5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide has a molecular weight of 255.70 g/mol, XLogP of 1.55, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-[(3-hydroxycyclobutyl)methyl]benzamide is sourced from PubChem (CID 66005764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).