N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide

C21H25NO2 — CID 121325134

IUPACN-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide
SMILESO=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(CO)cc1
InChIInChI=1S/C21H25NO2/c23-15-17-8-12-20(13-9-17)22-21(24)14-16-6-10-19(11-7-16)18-4-2-1-3-5-18/h1-5,8-9,12-13,16,19,23H,6-7,10-11,14-15H2,(H,22,24)
InChIKeyPLAHKALAVLJMGX-UHFFFAOYSA-N
MW323.44 g/mol
LogP4.48
Rot. Bonds5

About N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide

N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide (PubChem CID 121325134) has the molecular formula C21H25NO2 and a molecular weight of 323.44 g/mol. Its IUPAC name is N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide.

Molecular Properties

Compound NameN-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide
PubChem CID121325134
Molecular FormulaC21H25NO2
Molecular Weight323.44 g/mol
Exact Mass323.19
IUPAC NameN-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide
SMILESO=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(CO)cc1
InChIInChI=1S/C21H25NO2/c23-15-17-8-12-20(13-9-17)22-21(24)14-16-6-10-19(11-7-16)18-4-2-1-3-5-18/h1-5,8-9,12-13,16,19,23H,6-7,10-11,14-15H2,(H,22,24)
InChIKeyPLAHKALAVLJMGX-UHFFFAOYSA-N
XLogP4.48
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2-(4-phenylcyclohexyl)-N-(4-phenylphenyl)acetamide
CID 145078209
2-cyclopropyl-N-phenylacetamide
CID 60753326
N-(4-cyanophenyl)-2-[(1R,3S)-3-phenylcyclopentyl]acetamide
CID 121324973
3-[4-[2-(4-chloroanilino)-2-oxoethyl]cyclohexyl]benzoic acid
CID 121319777
5-[[[2-(4-phenylcyclohexyl)acetyl]amino]methyl]furan-2-carboxylic acid
CID 119246162
N-(2,3-difluorophenyl)-2-(4-phenylcyclohexyl)acetamide
CID 174866386
N-[4-(hydroxymethyl)phenyl]-3-phenylpiperidine-1-carboxamide
CID 166262555
N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide
CID 161440636
N-[2-(4-aminophenyl)ethyl]-2-(4-phenylcyclohexyl)acetamide
CID 119549120
2-cyclopropyl-N-(4-sulfanylphenyl)acetamide
CID 68600520
2-[4-[4-(phenylmethoxycarbonylamino)phenyl]cyclohexyl]acetic acid
CID 59464034
2-(oxan-4-yl)-N-phenylacetamide
CID 110856528

Frequently Asked Questions

What is the IUPAC name of N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide?
The IUPAC name of N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide (CID 121325134) is N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide.
What is the SMILES notation for N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide?
The canonical SMILES for N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide is O=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(CO)cc1.
What is the InChIKey of N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide?
The InChIKey is PLAHKALAVLJMGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25NO2/c23-15-17-8-12-20(13-9-17)22-21(24)14-16-6-10-19(11-7-16)18-4-2-1-3-5-18/h1-5,8-9,12-13,16,19,23H,6-7,10-11,14-15H2,(H,22,24).
What are the key properties of N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide?
N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide has a molecular weight of 323.44 g/mol, XLogP of 4.48, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(hydroxymethyl)phenyl]-2-(4-phenylcyclohexyl)acetamide is sourced from PubChem (CID 121325134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).