2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide

C15H21NO2 — CID 70447762

IUPAC2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide
SMILESCNC(=O)C(c1ccccc1)C1(O)CCCCC1
InChIInChI=1S/C15H21NO2/c1-16-14(17)13(12-8-4-2-5-9-12)15(18)10-6-3-7-11-15/h2,4-5,8-9,13,18H,3,6-7,10-11H2,1H3,(H,16,17)
InChIKeySLXKALSQPDYNEW-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.21
Rot. Bonds3

About 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide

2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide (PubChem CID 70447762) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide
PubChem CID70447762
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Name2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide
SMILESCNC(=O)C(c1ccccc1)C1(O)CCCCC1
InChIInChI=1S/C15H21NO2/c1-16-14(17)13(12-8-4-2-5-9-12)15(18)10-6-3-7-11-15/h2,4-5,8-9,13,18H,3,6-7,10-11H2,1H3,(H,16,17)
InChIKeySLXKALSQPDYNEW-UHFFFAOYSA-N
XLogP2.21
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 ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-hydroxycyclohexyl)-2-(4-hydroxyphenyl)-N-methylacetamide
CID 71134524
(2S)-N-methyl-2-phenyl-2-piperidin-1-ylacetamide
CID 67962694
2-(1-hydroxycyclohexyl)-2-[4-(2-phenylethyl)phenyl]acetic acid
CID 68855874
2-(dimethylamino)ethyl 2-(1-hydroxycyclopentyl)-2-phenylacetate chloride
CID 45114073
2-(dimethylamino)ethyl (2R)-2-(1-hydroxycyclopentyl)-2-phenylacetate;hydrochloride
CID 46224605
N,N'-dimethyl-2,3-diphenylbutanediamide
CID 15634660
(2S)-2-(4-fluorophenyl)-2-(1-hydroxycyclohexyl)acetic acid
CID 129389781
(2S)-2-(1-hydroxycyclohexyl)-2-(4-trimethylsilylphenyl)acetic acid
CID 125466602
1-[(R)-amino(phenyl)methyl]cycloheptan-1-ol
CID 22084843
2-(3-chlorophenyl)-2-(1-hydroxycyclohexyl)acetic acid
CID 68853928
N-methyl-2-(1-phenylcyclohexyl)butanamide
CID 68983886
benzyl-diethyl-[2-[2-(1-hydroxycyclohexyl)-2-phenylacetyl]oxyethyl]azanium bromide
CID 134828179

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide?
The IUPAC name of 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide (CID 70447762) is 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide.
What is the SMILES notation for 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide?
The canonical SMILES for 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide is CNC(=O)C(c1ccccc1)C1(O)CCCCC1.
What is the InChIKey of 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide?
The InChIKey is SLXKALSQPDYNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-16-14(17)13(12-8-4-2-5-9-12)15(18)10-6-3-7-11-15/h2,4-5,8-9,13,18H,3,6-7,10-11H2,1H3,(H,16,17).
What are the key properties of 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide?
2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide has a molecular weight of 247.34 g/mol, XLogP of 2.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclohexyl)-N-methyl-2-phenylacetamide is sourced from PubChem (CID 70447762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).