N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide

C15H21NO2 — CID 71786211

IUPACN-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)NC2CCCC(O)C2)c1
InChIInChI=1S/C15H21NO2/c1-11-4-2-5-12(8-11)9-15(18)16-13-6-3-7-14(17)10-13/h2,4-5,8,13-14,17H,3,6-7,9-10H2,1H3,(H,16,18)
InChIKeySTQGBBRNTCZWHS-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.96
Rot. Bonds3

About N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide

N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide (PubChem CID 71786211) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide
PubChem CID71786211
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)NC2CCCC(O)C2)c1
InChIInChI=1S/C15H21NO2/c1-11-4-2-5-12(8-11)9-15(18)16-13-6-3-7-14(17)10-13/h2,4-5,8,13-14,17H,3,6-7,9-10H2,1H3,(H,16,18)
InChIKeySTQGBBRNTCZWHS-UHFFFAOYSA-N
XLogP1.96
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-(3-methylphenyl)acetamide
CID 6467373
N-(4-aminocyclohexyl)-2-(3-methylphenyl)acetamide
CID 62387693
N-[2-(bromomethyl)cyclopentyl]-2-(3-methylphenyl)acetamide
CID 106366301
N-(1-acetylpiperidin-4-yl)-2-(3-methylphenyl)acetamide
CID 110715006
2-(3-aminophenyl)-N-[(1R,3R)-3-methylcyclohexyl]acetamide
CID 28689697
N-cyclohexyl-2-[(3-methylphenyl)methylamino]acetamide
CID 60903369
methyl 4-[[2-(3-methylphenyl)acetyl]amino]piperidine-1-carboxylate
CID 110821768
2-(3-methylphenyl)-N-(1-pyrimidin-2-ylpiperidin-4-yl)acetamide
CID 110712574
N-cyclopentyl-3-[(3-methylphenyl)methylamino]propanamide
CID 109013435
N-(1-benzylpiperidin-4-yl)-2-(3-methylphenyl)acetamide
CID 6465155
N-[1-(3,3-dimethylbutanoyl)piperidin-4-yl]-2-(3-methylphenyl)acetamide
CID 110822276
N-cyclohexyl-3-[(3-methylphenyl)methylamino]propanamide
CID 109013960

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide?
The IUPAC name of N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide (CID 71786211) is N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide is Cc1cccc(CC(=O)NC2CCCC(O)C2)c1.
What is the InChIKey of N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide?
The InChIKey is STQGBBRNTCZWHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-11-4-2-5-12(8-11)9-15(18)16-13-6-3-7-14(17)10-13/h2,4-5,8,13-14,17H,3,6-7,9-10H2,1H3,(H,16,18).
What are the key properties of N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide?
N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide has a molecular weight of 247.34 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxycyclohexyl)-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 71786211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).