3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide

C16H23NO3 — CID 111446107

IUPAC3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide
SMILESCCOc1cccc(C(=O)NCC2(O)CCCCC2)c1
InChIInChI=1S/C16H23NO3/c1-2-20-14-8-6-7-13(11-14)15(18)17-12-16(19)9-4-3-5-10-16/h6-8,11,19H,2-5,9-10,12H2,1H3,(H,17,18)
InChIKeySWUGCWNHEZSCCB-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.51
Rot. Bonds5

About 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide

3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide (PubChem CID 111446107) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide.

Molecular Properties

Compound Name3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide
PubChem CID111446107
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC Name3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide
SMILESCCOc1cccc(C(=O)NCC2(O)CCCCC2)c1
InChIInChI=1S/C16H23NO3/c1-2-20-14-8-6-7-13(11-14)15(18)17-12-16(19)9-4-3-5-10-16/h6-8,11,19H,2-5,9-10,12H2,1H3,(H,17,18)
InChIKeySWUGCWNHEZSCCB-UHFFFAOYSA-N
XLogP2.51
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide
CID 64866990
N-[(1-hydroxycyclohexyl)methyl]-3-methylbenzamide
CID 64868051
N-[(1-hydroxycycloheptyl)methyl]-3-pyridin-4-yloxybenzamide
CID 111433205
1-[(3-ethoxybenzoyl)amino]cycloheptane-1-carboxylic acid
CID 120539178
3-ethoxy-N-[2-[(3-ethoxybenzoyl)amino]ethyl]benzamide
CID 4958095
3-(dimethylamino)-N-[(1-hydroxycycloheptyl)methyl]benzamide
CID 65123540
3-ethoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzamide
CID 120888252
N-[(1-hydroxycyclohexyl)methyl]-3-methylsulfonylbenzamide
CID 64866337
3-ethoxy-N-[3-[(3-ethoxybenzoyl)amino]propyl]benzamide
CID 4958099
N-[[1-(chloromethyl)cyclohexyl]methyl]-3-methoxybenzamide
CID 103969532
1-[[(3-ethoxyphenyl)methylamino]methyl]cycloheptan-1-ol
CID 60908745
1-[3-[(1-hydroxycycloheptyl)methoxy]phenyl]butan-1-one
CID 69097313

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide?
The IUPAC name of 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide (CID 111446107) is 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide.
What is the SMILES notation for 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide?
The canonical SMILES for 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide is CCOc1cccc(C(=O)NCC2(O)CCCCC2)c1.
What is the InChIKey of 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide?
The InChIKey is SWUGCWNHEZSCCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-2-20-14-8-6-7-13(11-14)15(18)17-12-16(19)9-4-3-5-10-16/h6-8,11,19H,2-5,9-10,12H2,1H3,(H,17,18).
What are the key properties of 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide?
3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide has a molecular weight of 277.36 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[(1-hydroxycyclohexyl)methyl]benzamide is sourced from PubChem (CID 111446107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).