N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide

C22H27NO2 — CID 14897688

IUPACN-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide
SMILESCc1ccc(C(O)(Cc2ccccc2)C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C22H27NO2/c1-17-12-14-19(15-13-17)22(25,16-18-8-4-2-5-9-18)21(24)23-20-10-6-3-7-11-20/h2,4-5,8-9,12-15,20,25H,3,6-7,10-11,16H2,1H3,(H,23,24)
InChIKeyILCWOMGHLNXLST-UHFFFAOYSA-N
MW337.46 g/mol
LogP3.87
Rot. Bonds5

About N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide

N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide (PubChem CID 14897688) has the molecular formula C22H27NO2 and a molecular weight of 337.46 g/mol. Its IUPAC name is N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide
PubChem CID14897688
Molecular FormulaC22H27NO2
Molecular Weight337.46 g/mol
Exact Mass337.20
IUPAC NameN-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide
SMILESCc1ccc(C(O)(Cc2ccccc2)C(=O)NC2CCCCC2)cc1
InChIInChI=1S/C22H27NO2/c1-17-12-14-19(15-13-17)22(25,16-18-8-4-2-5-9-18)21(24)23-20-10-6-3-7-11-20/h2,4-5,8-9,12-15,20,25H,3,6-7,10-11,16H2,1H3,(H,23,24)
InChIKeyILCWOMGHLNXLST-UHFFFAOYSA-N
XLogP3.87
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.46
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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4-[4-[(2R)-2-[[(2R)-2-hydroxy-2-phenylethyl]amino]propyl]phenyl]benzoic acid
CID 24895789
(2S)-N-[(2S)-1-[butyl(methyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]-2-[(2,2-dihydroxy-2-phenylacetyl)amino]-4-methylpentanamide
CID 44300242
N-(2-hydroxy-2-phenylethyl)-2-(4-methylphenyl)acetamide
CID 5079333
(2R)-2-cyclopentyl-2-hydroxy-N-[1-(4-methylpent-3-enyl)-4-piperidinyl]-2-phenylacetamide
CID 9821459
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2-(3-Fluoro-cyclopentyl)-2-hydroxy-N-[1-(4-methyl-pent-3-enyl)-piperidin-4-yl]-2-phenyl-acetamide
CID 10597259
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CID 10598540
2-(3,3-Difluoro-cyclopentyl)-2-hydroxy-N-[1-(4-methyl-pent-3-enyl)-piperidin-4-yl]-2-phenyl-acetamide
CID 10622033
(2R)-2-[(1S,3R)-3-fluorocyclopentyl]-2-hydroxy-N-[1-(4-methylpent-3-enyl)piperidin-4-yl]-2-phenylacetamide
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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide?
The IUPAC name of N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide (CID 14897688) is N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide.
What is the SMILES notation for N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide?
The canonical SMILES for N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide is Cc1ccc(C(O)(Cc2ccccc2)C(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide?
The InChIKey is ILCWOMGHLNXLST-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO2/c1-17-12-14-19(15-13-17)22(25,16-18-8-4-2-5-9-18)21(24)23-20-10-6-3-7-11-20/h2,4-5,8-9,12-15,20,25H,3,6-7,10-11,16H2,1H3,(H,23,24).
What are the key properties of N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide?
N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide has a molecular weight of 337.46 g/mol, XLogP of 3.87, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-hydroxy-2-(4-methylphenyl)-3-phenylpropanamide is sourced from PubChem (CID 14897688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).