N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide

C17H26N2O2 — CID 61030317

IUPACN-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide
SMILESCC(C)COc1cccc(NC(=O)CC2CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-13(2)12-21-16-5-3-4-15(11-16)19-17(20)10-14-6-8-18-9-7-14/h3-5,11,13-14,18H,6-10,12H2,1-2H3,(H,19,20)
InChIKeyONZCEEUKJWDFLR-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.05
Rot. Bonds6

About N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide

N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide (PubChem CID 61030317) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide
PubChem CID61030317
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide
SMILESCC(C)COc1cccc(NC(=O)CC2CCNCC2)c1
InChIInChI=1S/C17H26N2O2/c1-13(2)12-21-16-5-3-4-15(11-16)19-17(20)10-14-6-8-18-9-7-14/h3-5,11,13-14,18H,6-10,12H2,1-2H3,(H,19,20)
InChIKeyONZCEEUKJWDFLR-UHFFFAOYSA-N
XLogP3.05
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 ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(2-methylpropoxy)phenyl]-2-(3-oxopiperazin-2-yl)acetamide
CID 54794746
3-[3-(2-methylpropoxy)anilino]-3-oxopropanoic acid
CID 62230040
N-[3-(2-methylpropoxy)phenyl]-3-piperidin-3-ylbutanamide;hydrochloride
CID 119714898
N-[3-(2-methylpropoxy)phenyl]acetamide
CID 23343374
1,3-bis[3-(2-methylpropoxy)phenyl]urea
CID 17170442
2-cyclopentyl-N-[4-(2-methylpropoxy)phenyl]acetamide
CID 54786144
N-[3-(2-methylpropoxy)phenyl]piperidine-2-carboxamide
CID 60927108
N-(3,5-dimethoxyphenyl)-2-piperidin-4-ylacetamide
CID 24703765
methyl 4-[3-(2-methylpropoxy)anilino]-4-oxobutanoate
CID 17079568
2-anilino-N-[3-(2-methylpropoxy)phenyl]acetamide
CID 54810289
ethyl 3-[3-(2-methylpropoxy)anilino]-3-oxopropanoate
CID 17097553
N-[3-(2-methoxyethoxy)phenyl]-2-piperidin-3-ylacetamide
CID 62675255

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide?
The IUPAC name of N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide (CID 61030317) is N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide?
The canonical SMILES for N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide is CC(C)COc1cccc(NC(=O)CC2CCNCC2)c1.
What is the InChIKey of N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide?
The InChIKey is ONZCEEUKJWDFLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-13(2)12-21-16-5-3-4-15(11-16)19-17(20)10-14-6-8-18-9-7-14/h3-5,11,13-14,18H,6-10,12H2,1-2H3,(H,19,20).
What are the key properties of N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide?
N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide has a molecular weight of 290.41 g/mol, XLogP of 3.05, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methylpropoxy)phenyl]-2-piperidin-4-ylacetamide is sourced from PubChem (CID 61030317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).