2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide

C22H32N2O3 — CID 2579923

IUPAC2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
SMILESCC(=O)c1ccc(OCC(=O)NCC2(N3CCCCC3)CCCCC2)cc1
InChIInChI=1S/C22H32N2O3/c1-18(25)19-8-10-20(11-9-19)27-16-21(26)23-17-22(12-4-2-5-13-22)24-14-6-3-7-15-24/h8-11H,2-7,12-17H2,1H3,(H,23,26)
InChIKeyRMYDGQZXNMKLHS-UHFFFAOYSA-N
MW372.51 g/mol
LogP3.57
Rot. Bonds7

About 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide

2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide (PubChem CID 2579923) has the molecular formula C22H32N2O3 and a molecular weight of 372.51 g/mol. Its IUPAC name is 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
PubChem CID2579923
Molecular FormulaC22H32N2O3
Molecular Weight372.51 g/mol
Exact Mass372.24
IUPAC Name2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
SMILESCC(=O)c1ccc(OCC(=O)NCC2(N3CCCCC3)CCCCC2)cc1
InChIInChI=1S/C22H32N2O3/c1-18(25)19-8-10-20(11-9-19)27-16-21(26)23-17-22(12-4-2-5-13-22)24-14-6-3-7-15-24/h8-11H,2-7,12-17H2,1H3,(H,23,26)
InChIKeyRMYDGQZXNMKLHS-UHFFFAOYSA-N
XLogP3.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.51
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-cyanophenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide
CID 2426774
2-(4-acetylphenoxy)-N-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 47094171
4-[[(2R)-oxolan-2-yl]methoxy]-N-[(1-piperidin-1-ylcyclohexyl)methyl]benzamide
CID 7824799
2-(3-chlorophenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide;hydrochloride
CID 20994956
N-(1,2,3,4,6,7,8,9-octahydroquinolizin-9a-ylmethyl)acetamide
CID 121011981
2-(2-chlorophenoxy)-N-[(1-morpholin-4-ylcyclohexyl)methyl]acetamide;hydrochloride
CID 20994960
2-(4-acetylphenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
CID 26905349
2-(4-acetylphenoxy)-N-cyclohexylacetamide
CID 2621514
4-(methylamino)-N-[(1-piperidin-1-ylcyclohexyl)methyl]butanamide
CID 61249197
4-piperidin-1-yl-N-[(1-pyrrolidin-1-ylcyclopentyl)methyl]benzamide
CID 91760256
N-[(3-morpholin-4-ylthiolan-3-yl)methyl]-2-(4-propanoylphenoxy)acetamide
CID 55658606
[1-[[[2-(4-benzoylphenoxy)acetyl]amino]methyl]cyclohexyl]-dimethylazanium
CID 7696515

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The IUPAC name of 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide (CID 2579923) is 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide.
What is the SMILES notation for 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The canonical SMILES for 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide is CC(=O)c1ccc(OCC(=O)NCC2(N3CCCCC3)CCCCC2)cc1.
What is the InChIKey of 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
The InChIKey is RMYDGQZXNMKLHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N2O3/c1-18(25)19-8-10-20(11-9-19)27-16-21(26)23-17-22(12-4-2-5-13-22)24-14-6-3-7-15-24/h8-11H,2-7,12-17H2,1H3,(H,23,26).
What are the key properties of 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide?
2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide has a molecular weight of 372.51 g/mol, XLogP of 3.57, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylphenoxy)-N-[(1-piperidin-1-ylcyclohexyl)methyl]acetamide is sourced from PubChem (CID 2579923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).