N-cyclohexyl-3-(hydroxymethyl)benzamide

C14H19NO2 — CID 91471935

IUPACN-cyclohexyl-3-(hydroxymethyl)benzamide
SMILESO=C(NC1CCCCC1)c1cccc(CO)c1
InChIInChI=1S/C14H19NO2/c16-10-11-5-4-6-12(9-11)14(17)15-13-7-2-1-3-8-13/h4-6,9,13,16H,1-3,7-8,10H2,(H,15,17)
InChIKeyIYTZTIRKUSHHKE-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.24
Rot. Bonds3

About N-cyclohexyl-3-(hydroxymethyl)benzamide

N-cyclohexyl-3-(hydroxymethyl)benzamide (PubChem CID 91471935) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-cyclohexyl-3-(hydroxymethyl)benzamide.

Molecular Properties

Compound NameN-cyclohexyl-3-(hydroxymethyl)benzamide
PubChem CID91471935
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-cyclohexyl-3-(hydroxymethyl)benzamide
SMILESO=C(NC1CCCCC1)c1cccc(CO)c1
InChIInChI=1S/C14H19NO2/c16-10-11-5-4-6-12(9-11)14(17)15-13-7-2-1-3-8-13/h4-6,9,13,16H,1-3,7-8,10H2,(H,15,17)
InChIKeyIYTZTIRKUSHHKE-UHFFFAOYSA-N
XLogP2.24
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-aminoethyl)-N-cyclohexylbenzamide
CID 62591538
N-cyclooctyl-3-methylbenzamide
CID 966011
3-(cyanomethyl)-N-cyclopentylbenzamide
CID 82178994
N-cyclopentyl-4-(hydroxymethyl)benzamide
CID 60636896
N-cyclopropyl-2-[3-(hydroxymethyl)phenyl]pyridine-4-carboxamide
CID 121497473
1-N-cyclohexyl-3-N-propan-2-ylbenzene-1,3-dicarboxamide
CID 109050479
N-cyclopentyl-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 9209303
[3-(cyclopentylcarbamoyl)phenyl]borinic acid
CID 142459248
N-cyclohexyl-3-(methoxyamino)benzamide
CID 142229646
3-N-tert-butyl-1-N-cycloheptylbenzene-1,3-dicarboxamide
CID 109055977
N-cyclohexyl-2-[3-(hydroxymethyl)phenoxy]acetamide
CID 28562082
3-[(cyclohexylcarbamoylamino)methyl]benzoic acid
CID 60894600

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-(hydroxymethyl)benzamide?
The IUPAC name of N-cyclohexyl-3-(hydroxymethyl)benzamide (CID 91471935) is N-cyclohexyl-3-(hydroxymethyl)benzamide.
What is the SMILES notation for N-cyclohexyl-3-(hydroxymethyl)benzamide?
The canonical SMILES for N-cyclohexyl-3-(hydroxymethyl)benzamide is O=C(NC1CCCCC1)c1cccc(CO)c1.
What is the InChIKey of N-cyclohexyl-3-(hydroxymethyl)benzamide?
The InChIKey is IYTZTIRKUSHHKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c16-10-11-5-4-6-12(9-11)14(17)15-13-7-2-1-3-8-13/h4-6,9,13,16H,1-3,7-8,10H2,(H,15,17).
What are the key properties of N-cyclohexyl-3-(hydroxymethyl)benzamide?
N-cyclohexyl-3-(hydroxymethyl)benzamide has a molecular weight of 233.31 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-(hydroxymethyl)benzamide is sourced from PubChem (CID 91471935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).