3-(1-hydroxycyclohexyl)benzamide

C13H17NO2 — CID 175712607

IUPAC3-(1-hydroxycyclohexyl)benzamide
SMILESNC(=O)c1cccc(C2(O)CCCCC2)c1
InChIInChI=1S/C13H17NO2/c14-12(15)10-5-4-6-11(9-10)13(16)7-2-1-3-8-13/h4-6,9,16H,1-3,7-8H2,(H2,14,15)
InChIKeyVDXPTZCUGUMFSB-UHFFFAOYSA-N
MW219.28 g/mol
LogP1.94
Rot. Bonds2

About 3-(1-hydroxycyclohexyl)benzamide

3-(1-hydroxycyclohexyl)benzamide (PubChem CID 175712607) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is 3-(1-hydroxycyclohexyl)benzamide.

Molecular Properties

Compound Name3-(1-hydroxycyclohexyl)benzamide
PubChem CID175712607
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC Name3-(1-hydroxycyclohexyl)benzamide
SMILESNC(=O)c1cccc(C2(O)CCCCC2)c1
InChIInChI=1S/C13H17NO2/c14-12(15)10-5-4-6-11(9-10)13(16)7-2-1-3-8-13/h4-6,9,16H,1-3,7-8H2,(H2,14,15)
InChIKeyVDXPTZCUGUMFSB-UHFFFAOYSA-N
XLogP1.94
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(1-hydroxycyclopentyl)phenyl]benzamide
CID 176725506
3-[(3S,4S)-1-[2-[3-(1-hydroxycyclohexyl)phenyl]ethyl]-3,4-dimethylpiperidin-4-yl]benzamide
CID 11351026
acetic acid;guanidine;1-phenylcyclohexan-1-ol
CID 174473231
methyl 3-(1-hydroxycyclopropyl)benzoate
CID 130756683
1-[3-(4-hydroxyoxan-4-yl)phenyl]ethanone
CID 105475536
copper;1-phenylcyclohexan-1-ol
CID 174727157
3-[(1S,2S,3S)-1-hydroxy-2,3-bis(hydroxymethyl)cyclobutyl]benzamide
CID 10800732
3-[[2-(1-aminocyclohexyl)acetyl]amino]benzamide
CID 64678413
ethane;1-phenylcyclohexan-1-ol
CID 144640846
3-[(2R)-2-(methylcarbamothioyl)-1-oxothian-2-yl]benzamide
CID 45266383
3-[(1S,2S)-2-(methylcarbamothioyl)-1-oxothian-2-yl]benzamide
CID 54217706
1-(3-methylsulfanylphenyl)cyclopentan-1-ol
CID 170997592

Frequently Asked Questions

What is the IUPAC name of 3-(1-hydroxycyclohexyl)benzamide?
The IUPAC name of 3-(1-hydroxycyclohexyl)benzamide (CID 175712607) is 3-(1-hydroxycyclohexyl)benzamide.
What is the SMILES notation for 3-(1-hydroxycyclohexyl)benzamide?
The canonical SMILES for 3-(1-hydroxycyclohexyl)benzamide is NC(=O)c1cccc(C2(O)CCCCC2)c1.
What is the InChIKey of 3-(1-hydroxycyclohexyl)benzamide?
The InChIKey is VDXPTZCUGUMFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c14-12(15)10-5-4-6-11(9-10)13(16)7-2-1-3-8-13/h4-6,9,16H,1-3,7-8H2,(H2,14,15).
What are the key properties of 3-(1-hydroxycyclohexyl)benzamide?
3-(1-hydroxycyclohexyl)benzamide has a molecular weight of 219.28 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-hydroxycyclohexyl)benzamide is sourced from PubChem (CID 175712607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).