4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide

C17H25NO3 — CID 110000518

IUPAC4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
SMILESCC(C)(CO)NC(=O)c1ccc(OC2CCCCC2)cc1
InChIInChI=1S/C17H25NO3/c1-17(2,12-19)18-16(20)13-8-10-15(11-9-13)21-14-6-4-3-5-7-14/h8-11,14,19H,3-7,12H2,1-2H3,(H,18,20)
InChIKeyKLLACAMOFPPZSR-UHFFFAOYSA-N
MW291.39 g/mol
LogP2.90
Rot. Bonds5

About 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide

4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide (PubChem CID 110000518) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide.

Molecular Properties

Compound Name4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
PubChem CID110000518
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC Name4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide
SMILESCC(C)(CO)NC(=O)c1ccc(OC2CCCCC2)cc1
InChIInChI=1S/C17H25NO3/c1-17(2,12-19)18-16(20)13-8-10-15(11-9-13)21-14-6-4-3-5-7-14/h8-11,14,19H,3-7,12H2,1-2H3,(H,18,20)
InChIKeyKLLACAMOFPPZSR-UHFFFAOYSA-N
XLogP2.90
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-cyclopentyloxyphenyl)-3-(1-hydroxy-2-methylpropan-2-yl)urea
CID 110894513
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3-cyclopentyloxy-N-(1,3-dihydroxy-2-methylpropan-2-yl)benzamide
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4-cyclopentyloxy-N-(2-methoxyethyl)benzamide
CID 34396260
N-(2-aminoethyl)-4-cyclohexyloxybenzamide
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1-tert-butyl-4-cyclohexyloxybenzene
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4-(4-cyclohexyloxyphenyl)benzoic acid
CID 23005106
4-cyclohexyloxy-N-[(1S,4R)-4-(hydroxymethyl)cyclopent-2-en-1-yl]benzamide
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4-cycloheptyloxybenzamide
CID 141109251
N-(4-cyclopentyloxyphenyl)-4-ethoxybenzamide
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4-cyclohexyloxy-N-[(2R)-1-(methylamino)-1-oxopropan-2-yl]benzamide
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CID 119187857

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
The IUPAC name of 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide (CID 110000518) is 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide.
What is the SMILES notation for 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
The canonical SMILES for 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide is CC(C)(CO)NC(=O)c1ccc(OC2CCCCC2)cc1.
What is the InChIKey of 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
The InChIKey is KLLACAMOFPPZSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO3/c1-17(2,12-19)18-16(20)13-8-10-15(11-9-13)21-14-6-4-3-5-7-14/h8-11,14,19H,3-7,12H2,1-2H3,(H,18,20).
What are the key properties of 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide?
4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide has a molecular weight of 291.39 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyloxy-N-(1-hydroxy-2-methylpropan-2-yl)benzamide is sourced from PubChem (CID 110000518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).