N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide

C17H26N2O2 — CID 61171094

IUPACN-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide
SMILESCc1ccc(OCC(C)NC(=O)CC2CCNCC2)cc1
InChIInChI=1S/C17H26N2O2/c1-13-3-5-16(6-4-13)21-12-14(2)19-17(20)11-15-7-9-18-10-8-15/h3-6,14-15,18H,7-12H2,1-2H3,(H,19,20)
InChIKeyAPEUPQDGLOHYIF-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.27
Rot. Bonds6

About N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide

N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide (PubChem CID 61171094) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide
PubChem CID61171094
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide
SMILESCc1ccc(OCC(C)NC(=O)CC2CCNCC2)cc1
InChIInChI=1S/C17H26N2O2/c1-13-3-5-16(6-4-13)21-12-14(2)19-17(20)11-15-7-9-18-10-8-15/h3-6,14-15,18H,7-12H2,1-2H3,(H,19,20)
InChIKeyAPEUPQDGLOHYIF-UHFFFAOYSA-N
XLogP2.27
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-3-ylacetamide
CID 62677074
N-[2-[[(2R)-1-(4-methylphenoxy)propan-2-yl]amino]-2-oxoethyl]cyclopropanecarboxamide
CID 95157805
1-(4-methylphenoxy)-3-piperidin-4-ylpropan-2-ol
CID 135249199
(2R)-N-[1-(4-methylphenoxy)propan-2-yl]piperidine-2-carboxamide
CID 103809635
N-(4-hydroxybutan-2-yl)-2-piperidin-4-ylacetamide
CID 83177313
N-(4-methylpentan-2-yl)-2-piperidin-4-ylacetamide
CID 43372444
N-[(2R)-1-(4-methoxyphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 92680005
4-hydroxy-N-[1-(4-methylphenoxy)propan-2-yl]butanamide
CID 79192194
(3R)-1-methyl-N-[(2R)-1-(4-methylphenoxy)propan-2-yl]piperidine-3-carboxamide
CID 99970521
3-(4-methylphenoxy)-2-piperidin-4-ylpropanoic acid
CID 117239808
2-(2,5-dimethylphenyl)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
CID 132650444
2,2-dimethyl-N-[(2S)-1-(4-methylphenoxy)propan-2-yl]propanamide
CID 52773928

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide?
The IUPAC name of N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide (CID 61171094) is N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide?
The canonical SMILES for N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide is Cc1ccc(OCC(C)NC(=O)CC2CCNCC2)cc1.
What is the InChIKey of N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide?
The InChIKey is APEUPQDGLOHYIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13-3-5-16(6-4-13)21-12-14(2)19-17(20)11-15-7-9-18-10-8-15/h3-6,14-15,18H,7-12H2,1-2H3,(H,19,20).
What are the key properties of N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide?
N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenoxy)propan-2-yl]-2-piperidin-4-ylacetamide is sourced from PubChem (CID 61171094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).