2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide

C17H26N2O2 — CID 16895414

IUPAC2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide
SMILESCC(C)N1CCC(CNC(=O)COc2ccccc2)CC1
InChIInChI=1S/C17H26N2O2/c1-14(2)19-10-8-15(9-11-19)12-18-17(20)13-21-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3,(H,18,20)
InChIKeyIJYGGLOEWKSZGY-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.30
Rot. Bonds6

About 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide

2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide (PubChem CID 16895414) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide
PubChem CID16895414
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide
SMILESCC(C)N1CCC(CNC(=O)COc2ccccc2)CC1
InChIInChI=1S/C17H26N2O2/c1-14(2)19-10-8-15(9-11-19)12-18-17(20)13-21-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3,(H,18,20)
InChIKeyIJYGGLOEWKSZGY-UHFFFAOYSA-N
XLogP2.30
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-cyanophenoxy)-N-[[(3R)-1-propan-2-ylpyrrolidin-3-yl]methyl]acetamide
CID 94799999
2-(4-phenoxyphenoxy)-N-(1-propan-2-ylpiperidin-4-yl)acetamide
CID 51324308
2-phenoxy-N-[[1-(2-phenylethyl)piperidin-4-yl]methyl]acetamide
CID 16895752
2-(2-phenoxyethoxy)-N-[[(3S)-1-propan-2-ylpiperidin-3-yl]methyl]acetamide
CID 94800055
N-[(1-benzylpiperidin-4-yl)methyl]-2-(4-methylphenoxy)acetamide
CID 16895737
N-[2-(1-methylpiperidin-4-yl)ethyl]-2-phenoxyacetamide
CID 50875305
2-(4-methylphenoxy)-N-[[1-(2-methylpropyl)piperidin-4-yl]methyl]acetamide
CID 110291709
2-phenoxy-N-[[1-(pyridine-3-carbonyl)piperidin-4-yl]methyl]acetamide
CID 90521344
2-(4-benzoylphenoxy)-N-(cyclopropylmethyl)acetamide
CID 134038104
N-[(1-acetylpiperidin-4-yl)methyl]-2-(4-methylphenoxy)acetamide
CID 110736170
2-phenoxy-N-(piperidin-3-ylmethyl)acetamide
CID 60725547
N-[(3-bromocyclohexyl)methyl]-2-phenoxyacetamide
CID 114147724

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide?
The IUPAC name of 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide (CID 16895414) is 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide.
What is the SMILES notation for 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide?
The canonical SMILES for 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide is CC(C)N1CCC(CNC(=O)COc2ccccc2)CC1.
What is the InChIKey of 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide?
The InChIKey is IJYGGLOEWKSZGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-14(2)19-10-8-15(9-11-19)12-18-17(20)13-21-16-6-4-3-5-7-16/h3-7,14-15H,8-13H2,1-2H3,(H,18,20).
What are the key properties of 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide?
2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide has a molecular weight of 290.41 g/mol, XLogP of 2.30, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[(1-propan-2-ylpiperidin-4-yl)methyl]acetamide is sourced from PubChem (CID 16895414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).